methyl 3-[2-(4-chlorophenyl)sulfanylethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-(4-chlorophenyl)sulfanylethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: methyl 3-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-[(4-chlorophenyl)thio]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-[(4-chlorophenyl)thio]acetyl]amino]-5-phenyl-thiophene-2-carboxylic acid methyl ester Formula: C20H16ClNO3S2 MolecularWeight: 417.92894

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CSC3=CC=C(C=C3)Cl

InChI

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