methyl 4-(4-methoxyphenyl)-2-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-methoxyphenyl)-2-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-methoxyphenyl)-2-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-methoxyphenyl)-2-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-methoxyphenyl)-2-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-methoxyphenyl)-2-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C19H19N3O4S2 MolecularWeight: 417.50186

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)OC)C(=O)OC

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)OC)C(=O)OC

InChI

InChI=1S/C19H19N3O4S2/c1-22-9-8-20-19(22)28-11-15(23)21-17-16(18(24)26-3)14(10-27-17)12-4-6-13(25-2)7-5-12/h4-10H,11H2,1-3H3,(H,21,23)