ethyl 4-(2-chlorophenyl)-2-[(4-cyanophenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(2-chlorophenyl)-2-[(4-cyanophenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(2-chlorophenyl)-2-[(4-cyanobenzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(2-chlorophenyl)-2-[[(4-cyanophenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chlorophenyl)-2-[(4-cyanobenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-(2-chlorophenyl)-2-[(4-cyanobenzoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H15ClN2O3S MolecularWeight: 410.8734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H15ClN2O3S/c1-2-27-21(26)18-16(15-5-3-4-6-17(15)22)12-28-20(18)24-19(25)14-9-7-13(11-23)8-10-14/h3-10,12H,2H2,1H3,(H,24,25)