3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine

C156H239N75S15 — CID 165066358

IUPAC3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine
SMILESCC1CSC=C1CCNc1n[nH]c(N)n1.CNc1n[nH]c(NCCc2ccc(C)s2)n1.CNc1nc(N(C)CCc2ccc(C)s2)n[nH]1.Cc1cc(CCN(C)c2n[nH]c(N)n2)cs1.Cc1cc(CCNc2n[nH]c(N)n2)cs1.Cc1cc(CCNc2nc(N(C)C)n[nH]2)cs1.Cc1ccc(CCN(C)c2n[nH]c(N)n2)s1.Cc1ccc(CCN(C)c2nc(N(C)C)n[nH]2)s1.Cc1ccc(CCN(C)c2nnc(N)n2C)s1.Cc1ccc(CCNc2nc(N(C)C)n[nH]2)s1.Cc1ccc(CCNc2nnc(N(C)C)n2C)s1.Cc1ccc(CCNc2nnc(N)n2C)s1.Cc1sccc1CCN(C)c1n[nH]c(N)n1.Cc1sccc1CCNc1n[nH]c(N)n1.Cc1sccc1CCNc1nc(N(C)C)n[nH]1
InChIInChI=1S/2C12H19N5S.5C11H17N5S.5C10H15N5S.C9H13N5S.C9H15N5S.C9H13N5S/c1-9-5-6-10(18-9)7-8-17(4)12-13-11(14-15-12)16(2)3;1-9-5-6-10(18-9)7-8-13-11-14-15-12(16(2)3)17(11)4;1-8-9(5-7-17-8)4-6-12-10-13-11(15-14-10)16(2)3;1-8-6-9(7-17-8)4-5-12-10-13-11(15-14-10)16(2)3;1-8-4-5-9(17-8)6-7-15(2)11-14-13-10(12)16(11)3;1-8-4-5-9(17-8)6-7-12-10-13-11(15-14-10)16(2)3;1-8-4-5-9(17-8)6-7-16(3)11-13-10(12-2)14-15-11;1-7-8(4-6-16-7)3-5-15(2)10-12-9(11)13-14-10;1-7-5-8(6-16-7)3-4-15(2)10-12-9(11)13-14-10;1-7-3-4-8(16-7)5-6-15(2)10-12-9(11)13-14-10;1-7-3-4-8(16-7)5-6-12-10-14-13-9(11)15(10)2;1-7-3-4-8(16-7)5-6-12-10-13-9(11-2)14-15-10;1-6-7(3-5-15-6)2-4-11-9-12-8(10)13-14-9;1-6-4-15-5-7(6)2-3-11-9-12-8(10)13-14-9;1-6-4-7(5-15-6)2-3-11-9-12-8(10)13-14-9/h5-6H,7-8H2,1-4H3,(H,13,14,15);5-6H,7-8H2,1-4H3,(H,13,14);5,7H,4,6H2,1-3H3,(H2,12,13,14,15);6-7H,4-5H2,1-3H3,(H2,12,13,14,15);4-5H,6-7H2,1-3H3,(H2,12,13);2*4-5H,6-7H2,1-3H3,(H2,12,13,14,15);4,6H,3,5H2,1-2H3,(H3,11,12,13,14);5-6H,3-4H2,1-2H3,(H3,11,12,13,14);3-4H,5-6H2,1-2H3,(H3,11,12,13,14);3-4H,5-6H2,1-2H3,(H2,11,13)(H,12,14);3-4H,5-6H2,1-2H3,(H3,11,12,13,14,15);3,5H,2,4H2,1H3,(H4,10,11,12,13,14);5-6H,2-4H2,1H3,(H4,10,11,12,13,14);4-5H,2-3H2,1H3,(H4,10,11,12,13,14)
InChIKeySAJWRHYFDQLVRU-UHFFFAOYSA-N
MW3646.16 g/mol
LogP24.73
Rot. Bonds67

About 3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine

3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine (PubChem CID 165066358) has the molecular formula C156H239N75S15 and a molecular weight of 3646.16 g/mol. Its IUPAC name is 3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine.

Molecular Properties

Compound Name3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine
PubChem CID165066358
Molecular FormulaC156H239N75S15
Molecular Weight3646.16 g/mol
Exact Mass3642.68
IUPAC Name3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine
SMILESCC1CSC=C1CCNc1n[nH]c(N)n1.CNc1n[nH]c(NCCc2ccc(C)s2)n1.CNc1nc(N(C)CCc2ccc(C)s2)n[nH]1.Cc1cc(CCN(C)c2n[nH]c(N)n2)cs1.Cc1cc(CCNc2n[nH]c(N)n2)cs1.Cc1cc(CCNc2nc(N(C)C)n[nH]2)cs1.Cc1ccc(CCN(C)c2n[nH]c(N)n2)s1.Cc1ccc(CCN(C)c2nc(N(C)C)n[nH]2)s1.Cc1ccc(CCN(C)c2nnc(N)n2C)s1.Cc1ccc(CCNc2nc(N(C)C)n[nH]2)s1.Cc1ccc(CCNc2nnc(N(C)C)n2C)s1.Cc1ccc(CCNc2nnc(N)n2C)s1.Cc1sccc1CCN(C)c1n[nH]c(N)n1.Cc1sccc1CCNc1n[nH]c(N)n1.Cc1sccc1CCNc1nc(N(C)C)n[nH]1
InChIInChI=1S/2C12H19N5S.5C11H17N5S.5C10H15N5S.C9H13N5S.C9H15N5S.C9H13N5S/c1-9-5-6-10(18-9)7-8-17(4)12-13-11(14-15-12)16(2)3;1-9-5-6-10(18-9)7-8-13-11-14-15-12(16(2)3)17(11)4;1-8-9(5-7-17-8)4-6-12-10-13-11(15-14-10)16(2)3;1-8-6-9(7-17-8)4-5-12-10-13-11(15-14-10)16(2)3;1-8-4-5-9(17-8)6-7-15(2)11-14-13-10(12)16(11)3;1-8-4-5-9(17-8)6-7-12-10-13-11(15-14-10)16(2)3;1-8-4-5-9(17-8)6-7-16(3)11-13-10(12-2)14-15-11;1-7-8(4-6-16-7)3-5-15(2)10-12-9(11)13-14-10;1-7-5-8(6-16-7)3-4-15(2)10-12-9(11)13-14-10;1-7-3-4-8(16-7)5-6-15(2)10-12-9(11)13-14-10;1-7-3-4-8(16-7)5-6-12-10-14-13-9(11)15(10)2;1-7-3-4-8(16-7)5-6-12-10-13-9(11-2)14-15-10;1-6-7(3-5-15-6)2-4-11-9-12-8(10)13-14-9;1-6-4-15-5-7(6)2-3-11-9-12-8(10)13-14-9;1-6-4-7(5-15-6)2-3-11-9-12-8(10)13-14-9/h5-6H,7-8H2,1-4H3,(H,13,14,15);5-6H,7-8H2,1-4H3,(H,13,14);5,7H,4,6H2,1-3H3,(H2,12,13,14,15);6-7H,4-5H2,1-3H3,(H2,12,13,14,15);4-5H,6-7H2,1-3H3,(H2,12,13);2*4-5H,6-7H2,1-3H3,(H2,12,13,14,15);4,6H,3,5H2,1-2H3,(H3,11,12,13,14);5-6H,3-4H2,1-2H3,(H3,11,12,13,14);3-4H,5-6H2,1-2H3,(H3,11,12,13,14);3-4H,5-6H2,1-2H3,(H2,11,13)(H,12,14);3-4H,5-6H2,1-2H3,(H3,11,12,13,14,15);3,5H,2,4H2,1H3,(H4,10,11,12,13,14);5-6H,2-4H2,1H3,(H4,10,11,12,13,14);4-5H,2-3H2,1H3,(H4,10,11,12,13,14)
InChIKeySAJWRHYFDQLVRU-UHFFFAOYSA-N
XLogP24.73
TPSA967.10 Ų
H-Bond Donors31
H-Bond Acceptors78
Rotatable Bonds67
Heavy Atoms246
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003646.16
LogP ≤ 524.73
H-Bond Donors ≤ 531
H-Bond Acceptors ≤ 1078

Analyze 3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine with MolForge

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What is the IUPAC name of 3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine?
The IUPAC name of 3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine (CID 165066358) is 3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine.
What is the SMILES notation for 3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine?
The canonical SMILES for 3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine is CC1CSC=C1CCNc1n[nH]c(N)n1.CNc1n[nH]c(NCCc2ccc(C)s2)n1.CNc1nc(N(C)CCc2ccc(C)s2)n[nH]1.Cc1cc(CCN(C)c2n[nH]c(N)n2)cs1.Cc1cc(CCNc2n[nH]c(N)n2)cs1.Cc1cc(CCNc2nc(N(C)C)n[nH]2)cs1.Cc1ccc(CCN(C)c2n[nH]c(N)n2)s1.Cc1ccc(CCN(C)c2nc(N(C)C)n[nH]2)s1.Cc1ccc(CCN(C)c2nnc(N)n2C)s1.Cc1ccc(CCNc2nc(N(C)C)n[nH]2)s1.Cc1ccc(CCNc2nnc(N(C)C)n2C)s1.Cc1ccc(CCNc2nnc(N)n2C)s1.Cc1sccc1CCN(C)c1n[nH]c(N)n1.Cc1sccc1CCNc1n[nH]c(N)n1.Cc1sccc1CCNc1nc(N(C)C)n[nH]1.
What is the InChIKey of 3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine?
The InChIKey is SAJWRHYFDQLVRU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H19N5S.5C11H17N5S.5C10H15N5S.C9H13N5S.C9H15N5S.C9H13N5S/c1-9-5-6-10(18-9)7-8-17(4)12-13-11(14-15-12)16(2)3;1-9-5-6-10(18-9)7-8-13-11-14-15-12(16(2)3)17(11)4;1-8-9(5-7-17-8)4-6-12-10-13-11(15-14-10)16(2)3;1-8-6-9(7-17-8)4-5-12-10-13-11(15-14-10)16(2)3;1-8-4-5-9(17-8)6-7-15(2)11-14-13-10(12)16(11)3;1-8-4-5-9(17-8)6-7-12-10-13-11(15-14-10)16(2)3;1-8-4-5-9(17-8)6-7-16(3)11-13-10(12-2)14-15-11;1-7-8(4-6-16-7)3-5-15(2)10-12-9(11)13-14-10;1-7-5-8(6-16-7)3-4-15(2)10-12-9(11)13-14-10;1-7-3-4-8(16-7)5-6-15(2)10-12-9(11)13-14-10;1-7-3-4-8(16-7)5-6-12-10-14-13-9(11)15(10)2;1-7-3-4-8(16-7)5-6-12-10-13-9(11-2)14-15-10;1-6-7(3-5-15-6)2-4-11-9-12-8(10)13-14-9;1-6-4-15-5-7(6)2-3-11-9-12-8(10)13-14-9;1-6-4-7(5-15-6)2-3-11-9-12-8(10)13-14-9/h5-6H,7-8H2,1-4H3,(H,13,14,15);5-6H,7-8H2,1-4H3,(H,13,14);5,7H,4,6H2,1-3H3,(H2,12,13,14,15);6-7H,4-5H2,1-3H3,(H2,12,13,14,15);4-5H,6-7H2,1-3H3,(H2,12,13);2*4-5H,6-7H2,1-3H3,(H2,12,13,14,15);4,6H,3,5H2,1-2H3,(H3,11,12,13,14);5-6H,3-4H2,1-2H3,(H3,11,12,13,14);3-4H,5-6H2,1-2H3,(H3,11,12,13,14);3-4H,5-6H2,1-2H3,(H2,11,13)(H,12,14);3-4H,5-6H2,1-2H3,(H3,11,12,13,14,15);3,5H,2,4H2,1H3,(H4,10,11,12,13,14);5-6H,2-4H2,1H3,(H4,10,11,12,13,14);4-5H,2-3H2,1H3,(H4,10,11,12,13,14).
What are the key properties of 3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine?
3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine has a molecular weight of 3646.16 g/mol, XLogP of 24.73, 67 rotatable bonds, 31 hydrogen bond donors, and 78 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N-dimethyl-5-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,4-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(3-methyl-2,3-dihydrothiophen-4-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N-[2-(2-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(5-methylthiophen-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-[2-(5-methylthiophen-2-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine is sourced from PubChem (CID 165066358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).