[(1S)-1-(4-chlorophenyl)-2-oxidanylidene-2-(phenethylamino)ethyl] thiophene-2-carboxylate

Systemtic Name: [(1S)-1-(4-chlorophenyl)-2-oxidanylidene-2-(phenethylamino)ethyl] thiophene-2-carboxylate Openeye Name: [(1S)-1-(4-chlorophenyl)-2-oxo-2-(phenethylamino)ethyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [(1S)-1-(4-chlorophenyl)-2-oxo-2-(phenethylamino)ethyl] ester IUPAC Name: [(1S)-1-(4-chlorophenyl)-2-oxo-2-(phenethylamino)ethyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [(1S)-1-(4-chlorophenyl)-2-keto-2-(phenethylamino)ethyl] ester Formula: C21H18ClNO3S MolecularWeight: 399.89052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C(C2=CC=C(C=C2)Cl)OC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)[C@H](C2=CC=C(C=C2)Cl)OC(=O)C3=CC=CS3

InChI

InChI=1S/C21H18ClNO3S/c22-17-10-8-16(9-11-17)19(26-21(25)18-7-4-14-27-18)20(24)23-13-12-15-5-2-1-3-6-15/h1-11,14,19H,12-13H2,(H,23,24)/t19-/m0/s1