About methyl 5-tert-butyl-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylphenyl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3-thiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 3-[(4-methylphenyl)carbamoylamino]-5-propan-2-ylthiophene-2-carboxylate
methyl 5-tert-butyl-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylphenyl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3-thiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 3-[(4-methylphenyl)carbamoylamino]-5-propan-2-ylthiophene-2-carboxylate (PubChem CID 157326123) has the molecular formula C127H159N23O24S14
and a molecular weight of 2840.74 g/mol. Its IUPAC name is methyl 5-tert-butyl-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylphenyl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3-thiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 3-[(4-methylphenyl)carbamoylamino]-5-propan-2-ylthiophene-2-carboxylate.
Frequently Asked Questions
What is the IUPAC name of methyl 5-tert-butyl-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylphenyl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3-thiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 3-[(4-methylphenyl)carbamoylamino]-5-propan-2-ylthiophene-2-carboxylate?
The IUPAC name of methyl 5-tert-butyl-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylphenyl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3-thiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 3-[(4-methylphenyl)carbamoylamino]-5-propan-2-ylthiophene-2-carboxylate (CID 157326123) is methyl 5-tert-butyl-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylphenyl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3-thiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 3-[(4-methylphenyl)carbamoylamino]-5-propan-2-ylthiophene-2-carboxylate.
What is the SMILES notation for methyl 5-tert-butyl-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylphenyl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3-thiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 3-[(4-methylphenyl)carbamoylamino]-5-propan-2-ylthiophene-2-carboxylate?
The canonical SMILES for methyl 5-tert-butyl-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylphenyl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3-thiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 3-[(4-methylphenyl)carbamoylamino]-5-propan-2-ylthiophene-2-carboxylate is CCc1nnc(NC(=O)Nc2cc(C(C)(C)C)sc2C(=O)OC)s1.COC(=O)c1sc(C(C)(C)C)cc1NC(=O)Nc1cc(C)cs1.COC(=O)c1sc(C(C)(C)C)cc1NC(=O)Nc1ccc(C)cc1.COC(=O)c1sc(C(C)(C)C)cc1NC(=O)Nc1ccc(C)s1.COC(=O)c1sc(C(C)(C)C)cc1NC(=O)Nc1ncc(C)s1.COC(=O)c1sc(C(C)(C)C)cc1NC(=O)Nc1nnc(C)s1.COC(=O)c1sc(C(C)(C)C)cc1NC(=O)Nc1nnc(C2CC2)s1.COC(=O)c1sc(C(C)C)cc1NC(=O)Nc1ccc(C)cc1.
What is the InChIKey of methyl 5-tert-butyl-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylphenyl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3-thiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 3-[(4-methylphenyl)carbamoylamino]-5-propan-2-ylthiophene-2-carboxylate?
The InChIKey is BESVRJXSZMQXDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3S.C17H20N2O3S.C16H20N4O3S2.2C16H20N2O3S2.C15H20N4O3S2.C15H19N3O3S2.C14H18N4O3S2/c1-11-6-8-12(9-7-11)19-17(22)20-13-10-14(18(2,3)4)24-15(13)16(21)23-5;1-10(2)14-9-13(15(23-14)16(20)22-4)19-17(21)18-12-7-5-11(3)6-8-12;1-16(2,3)10-7-9(11(24-10)13(21)23-4)17-14(22)18-15-20-19-12(25-15)8-5-6-8;1-9-6-12(22-8-9)18-15(20)17-10-7-11(16(2,3)4)23-13(10)14(19)21-5;1-9-6-7-12(22-9)18-15(20)17-10-8-11(16(2,3)4)23-13(10)14(19)21-5;1-6-10-18-19-14(24-10)17-13(21)16-8-7-9(15(2,3)4)23-11(8)12(20)22-5;1-8-7-16-14(22-8)18-13(20)17-9-6-10(15(2,3)4)23-11(9)12(19)21-5;1-7-17-18-13(22-7)16-12(20)15-8-6-9(14(2,3)4)23-10(8)11(19)21-5/h6-10H,1-5H3,(H2,19,20,22);5-10H,1-4H3,(H2,18,19,21);7-8H,5-6H2,1-4H3,(H2,17,18,20,22);2*6-8H,1-5H3,(H2,17,18,20);7H,6H2,1-5H3,(H2,16,17,19,21);6-7H,1-5H3,(H2,16,17,18,20);6H,1-5H3,(H2,15,16,18,20).
What are the key properties of methyl 5-tert-butyl-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylphenyl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3-thiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 3-[(4-methylphenyl)carbamoylamino]-5-propan-2-ylthiophene-2-carboxylate?
methyl 5-tert-butyl-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylphenyl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3-thiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 3-[(4-methylphenyl)carbamoylamino]-5-propan-2-ylthiophene-2-carboxylate has a molecular weight of 2840.74 g/mol, XLogP of 35.06, 27 rotatable bonds, 16 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-tert-butyl-3-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylphenyl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methyl-1,3-thiazol-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(4-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 5-tert-butyl-3-[(5-methylthiophen-2-yl)carbamoylamino]thiophene-2-carboxylate;methyl 3-[(4-methylphenyl)carbamoylamino]-5-propan-2-ylthiophene-2-carboxylate is sourced from PubChem (CID 157326123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).