3-N,3-N-dimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine

C146H217N75O2S13 — CID 158669792

IUPAC3-N,3-N-dimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine
SMILESCN(C)c1n[nH]c(N(C)CCc2cccs2)n1.CN(C)c1n[nH]c(N(C)CCc2ccsc2)n1.CN(C)c1n[nH]c(NCCc2cccs2)n1.CN(C)c1n[nH]c(NCCc2ccsc2)n1.CN(C)c1nnc(NCCc2cccs2)n1C.CN(C)c1nnc(NCCc2ccsc2)n1C.CN(CCc1ccoc1)c1n[nH]c(N)n1.CN(CCc1ccsc1)c1n[nH]c(N)n1.CNc1n[nH]c(NCCc2ccsc2)n1.CNc1nc(N(C)CCc2cccs2)n[nH]1.CNc1nc(N(C)CCc2ccsc2)n[nH]1.CNc1nc(N(C)CCc2ccsc2)n[nH]1.Cn1c(N)nnc1NCCc1ccsc1.Nc1nc(NCCc2ccoc2)n[nH]1.Nc1nc(NCCc2ccsc2)n[nH]1
InChIInChI=1S/4C11H17N5S.5C10H15N5S.C9H13N5O.3C9H13N5S.C8H11N5O.C8H11N5S/c1-15(2)10-12-11(14-13-10)16(3)6-4-9-5-7-17-8-9;1-15(2)11-14-13-10(16(11)3)12-6-4-9-5-7-17-8-9;1-15(2)10-12-11(14-13-10)16(3)7-6-9-5-4-8-17-9;1-15(2)11-14-13-10(16(11)3)12-7-6-9-5-4-8-17-9;1-15(2)10-12-9(13-14-10)11-5-3-8-4-6-16-7-8;2*1-11-9-12-10(14-13-9)15(2)5-3-8-4-6-16-7-8;1-15(2)10-12-9(13-14-10)11-6-5-8-4-3-7-16-8;1-11-9-12-10(14-13-9)15(2)6-5-8-4-3-7-16-8;2*1-14(9-11-8(10)12-13-9)4-2-7-3-5-15-6-7;1-14-8(10)12-13-9(14)11-4-2-7-3-5-15-6-7;1-10-8-12-9(14-13-8)11-4-2-7-3-5-15-6-7;2*9-7-11-8(13-12-7)10-3-1-6-2-4-14-5-6/h5,7-8H,4,6H2,1-3H3,(H,12,13,14);5,7-8H,4,6H2,1-3H3,(H,12,13);4-5,8H,6-7H2,1-3H3,(H,12,13,14);4-5,8H,6-7H2,1-3H3,(H,12,13);3*4,6-7H,3,5H2,1-2H3,(H2,11,12,13,14);2*3-4,7H,5-6H2,1-2H3,(H2,11,12,13,14);2*3,5-6H,2,4H2,1H3,(H3,10,11,12,13);3,5-6H,2,4H2,1H3,(H2,10,12)(H,11,13);3,5-6H,2,4H2,1H3,(H3,10,11,12,13,14);2*2,4-5H,1,3H2,(H4,9,10,11,12,13)
InChIKeyIDUOVRIRXAGROM-UHFFFAOYSA-N
MW3471.74 g/mol
LogP20.55
Rot. Bonds70

About 3-N,3-N-dimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine

3-N,3-N-dimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine (PubChem CID 158669792) has the molecular formula C146H217N75O2S13 and a molecular weight of 3471.74 g/mol. Its IUPAC name is 3-N,3-N-dimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine.

Molecular Properties

Compound Name3-N,3-N-dimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine
PubChem CID158669792
Molecular FormulaC146H217N75O2S13
Molecular Weight3471.74 g/mol
Exact Mass3468.56
IUPAC Name3-N,3-N-dimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine
SMILESCN(C)c1n[nH]c(N(C)CCc2cccs2)n1.CN(C)c1n[nH]c(N(C)CCc2ccsc2)n1.CN(C)c1n[nH]c(NCCc2cccs2)n1.CN(C)c1n[nH]c(NCCc2ccsc2)n1.CN(C)c1nnc(NCCc2cccs2)n1C.CN(C)c1nnc(NCCc2ccsc2)n1C.CN(CCc1ccoc1)c1n[nH]c(N)n1.CN(CCc1ccsc1)c1n[nH]c(N)n1.CNc1n[nH]c(NCCc2ccsc2)n1.CNc1nc(N(C)CCc2cccs2)n[nH]1.CNc1nc(N(C)CCc2ccsc2)n[nH]1.CNc1nc(N(C)CCc2ccsc2)n[nH]1.Cn1c(N)nnc1NCCc1ccsc1.Nc1nc(NCCc2ccoc2)n[nH]1.Nc1nc(NCCc2ccsc2)n[nH]1
InChIInChI=1S/4C11H17N5S.5C10H15N5S.C9H13N5O.3C9H13N5S.C8H11N5O.C8H11N5S/c1-15(2)10-12-11(14-13-10)16(3)6-4-9-5-7-17-8-9;1-15(2)11-14-13-10(16(11)3)12-6-4-9-5-7-17-8-9;1-15(2)10-12-11(14-13-10)16(3)7-6-9-5-4-8-17-9;1-15(2)11-14-13-10(16(11)3)12-7-6-9-5-4-8-17-9;1-15(2)10-12-9(13-14-10)11-5-3-8-4-6-16-7-8;2*1-11-9-12-10(14-13-9)15(2)5-3-8-4-6-16-7-8;1-15(2)10-12-9(13-14-10)11-6-5-8-4-3-7-16-8;1-11-9-12-10(14-13-9)15(2)6-5-8-4-3-7-16-8;2*1-14(9-11-8(10)12-13-9)4-2-7-3-5-15-6-7;1-14-8(10)12-13-9(14)11-4-2-7-3-5-15-6-7;1-10-8-12-9(14-13-8)11-4-2-7-3-5-15-6-7;2*9-7-11-8(13-12-7)10-3-1-6-2-4-14-5-6/h5,7-8H,4,6H2,1-3H3,(H,12,13,14);5,7-8H,4,6H2,1-3H3,(H,12,13);4-5,8H,6-7H2,1-3H3,(H,12,13,14);4-5,8H,6-7H2,1-3H3,(H,12,13);3*4,6-7H,3,5H2,1-2H3,(H2,11,12,13,14);2*3-4,7H,5-6H2,1-2H3,(H2,11,12,13,14);2*3,5-6H,2,4H2,1H3,(H3,10,11,12,13);3,5-6H,2,4H2,1H3,(H2,10,12)(H,11,13);3,5-6H,2,4H2,1H3,(H3,10,11,12,13,14);2*2,4-5H,1,3H2,(H4,9,10,11,12,13)
InChIKeyIDUOVRIRXAGROM-UHFFFAOYSA-N
XLogP20.55
TPSA933.83 Ų
H-Bond Donors29
H-Bond Acceptors78
Rotatable Bonds70
Heavy Atoms236
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003471.74
LogP ≤ 520.55
H-Bond Donors ≤ 529
H-Bond Acceptors ≤ 1078

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

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Frequently Asked Questions

What is the IUPAC name of 3-N,3-N-dimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine?
The IUPAC name of 3-N,3-N-dimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine (CID 158669792) is 3-N,3-N-dimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine.
What is the SMILES notation for 3-N,3-N-dimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine?
The canonical SMILES for 3-N,3-N-dimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine is CN(C)c1n[nH]c(N(C)CCc2cccs2)n1.CN(C)c1n[nH]c(N(C)CCc2ccsc2)n1.CN(C)c1n[nH]c(NCCc2cccs2)n1.CN(C)c1n[nH]c(NCCc2ccsc2)n1.CN(C)c1nnc(NCCc2cccs2)n1C.CN(C)c1nnc(NCCc2ccsc2)n1C.CN(CCc1ccoc1)c1n[nH]c(N)n1.CN(CCc1ccsc1)c1n[nH]c(N)n1.CNc1n[nH]c(NCCc2ccsc2)n1.CNc1nc(N(C)CCc2cccs2)n[nH]1.CNc1nc(N(C)CCc2ccsc2)n[nH]1.CNc1nc(N(C)CCc2ccsc2)n[nH]1.Cn1c(N)nnc1NCCc1ccsc1.Nc1nc(NCCc2ccoc2)n[nH]1.Nc1nc(NCCc2ccsc2)n[nH]1.
What is the InChIKey of 3-N,3-N-dimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine?
The InChIKey is IDUOVRIRXAGROM-UHFFFAOYSA-N. The full InChI is InChI=1S/4C11H17N5S.5C10H15N5S.C9H13N5O.3C9H13N5S.C8H11N5O.C8H11N5S/c1-15(2)10-12-11(14-13-10)16(3)6-4-9-5-7-17-8-9;1-15(2)11-14-13-10(16(11)3)12-6-4-9-5-7-17-8-9;1-15(2)10-12-11(14-13-10)16(3)7-6-9-5-4-8-17-9;1-15(2)11-14-13-10(16(11)3)12-7-6-9-5-4-8-17-9;1-15(2)10-12-9(13-14-10)11-5-3-8-4-6-16-7-8;2*1-11-9-12-10(14-13-9)15(2)5-3-8-4-6-16-7-8;1-15(2)10-12-9(13-14-10)11-6-5-8-4-3-7-16-8;1-11-9-12-10(14-13-9)15(2)6-5-8-4-3-7-16-8;2*1-14(9-11-8(10)12-13-9)4-2-7-3-5-15-6-7;1-14-8(10)12-13-9(14)11-4-2-7-3-5-15-6-7;1-10-8-12-9(14-13-8)11-4-2-7-3-5-15-6-7;2*9-7-11-8(13-12-7)10-3-1-6-2-4-14-5-6/h5,7-8H,4,6H2,1-3H3,(H,12,13,14);5,7-8H,4,6H2,1-3H3,(H,12,13);4-5,8H,6-7H2,1-3H3,(H,12,13,14);4-5,8H,6-7H2,1-3H3,(H,12,13);3*4,6-7H,3,5H2,1-2H3,(H2,11,12,13,14);2*3-4,7H,5-6H2,1-2H3,(H2,11,12,13,14);2*3,5-6H,2,4H2,1H3,(H3,10,11,12,13);3,5-6H,2,4H2,1H3,(H2,10,12)(H,11,13);3,5-6H,2,4H2,1H3,(H3,10,11,12,13,14);2*2,4-5H,1,3H2,(H4,9,10,11,12,13).
What are the key properties of 3-N,3-N-dimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine?
3-N,3-N-dimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine has a molecular weight of 3471.74 g/mol, XLogP of 20.55, 70 rotatable bonds, 29 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-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N-dimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,5-N-dimethyl-3-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;bis(3-N,5-N-dimethyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine);3-N-[2-(furan-3-yl)ethyl]-3-N-methyl-1H-1,2,4-triazole-3,5-diamine;3-N-[2-(furan-3-yl)ethyl]-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N-methyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;4-methyl-3-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-2-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,4-trimethyl-5-N-(2-thiophen-3-ylethyl)-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-3,5-diamine;3-N,3-N,5-N-trimethyl-5-N-(2-thiophen-3-ylethyl)-1H-1,2,4-triazole-3,5-diamine is sourced from PubChem (CID 158669792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).