methyl 4-(4-chlorophenyl)-2-(2-phenylsulfanylethanoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-chlorophenyl)-2-(2-phenylsulfanylethanoylamino)thiophene-3-carboxylate Openeye Name: methyl 4-(4-chlorophenyl)-2-[(2-phenylsulfanylacetyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-[[1-oxo-2-(phenylthio)ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-chlorophenyl)-2-[(2-phenylsulfanylacetyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-[[2-(phenylthio)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C20H16ClNO3S2 MolecularWeight: 417.92894

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)CSC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C20H16ClNO3S2/c1-25-20(24)18-16(13-7-9-14(21)10-8-13)11-27-19(18)22-17(23)12-26-15-5-3-2-4-6-15/h2-11H,12H2,1H3,(H,22,23)