methyl 4-(3-chlorophenyl)-2-[(4-methoxyphenyl)carbonylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 4-(3-chlorophenyl)-2-[(4-methoxyphenyl)carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 4-(3-chlorophenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(3-chlorophenyl)-2-[[(4-methoxyphenyl)-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-chlorophenyl)-2-[(4-methoxybenzoyl)amino]-5-methylthiophene-3-carboxylate Traditional Name: 4-(3-chlorophenyl)-5-methyl-2-(p-anisoylamino)thiophene-3-carboxylic acid methyl ester Formula: C21H18ClNO4S MolecularWeight: 415.88992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C2=CC=C(C=C2)OC)C(=O)OC)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C2=CC=C(C=C2)OC)C(=O)OC)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H18ClNO4S/c1-12-17(14-5-4-6-15(22)11-14)18(21(25)27-3)20(28-12)23-19(24)13-7-9-16(26-2)10-8-13/h4-11H,1-3H3,(H,23,24)