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

Systemtic Name: methyl 2-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylic acid methyl ester Formula: C19H19N3O3S2 MolecularWeight: 401.50246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CSC3=NC=CN3C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CSC3=NC=CN3C

InChI

InChI=1S/C19H19N3O3S2/c1-12-4-6-13(7-5-12)14-10-26-17(16(14)18(24)25-3)21-15(23)11-27-19-20-8-9-22(19)2/h4-10H,11H2,1-3H3,(H,21,23)