[2-oxidanylidene-2-[[(S)-phenyl(thiophen-2-yl)methyl]amino]ethyl] 3-azanyl-4-chloranyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[[(S)-phenyl(thiophen-2-yl)methyl]amino]ethyl] 3-azanyl-4-chloranyl-benzoate Openeye Name: [2-oxo-2-[[(S)-phenyl(2-thienyl)methyl]amino]ethyl] 3-amino-4-chloro-benzoate CAS Name: 3-amino-4-chlorobenzoic acid [2-oxo-2-[[(S)-phenyl(thiophen-2-yl)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(S)-phenyl(thiophen-2-yl)methyl]amino]ethyl] 3-amino-4-chlorobenzoate Traditional Name: 3-amino-4-chloro-benzoic acid [2-keto-2-[[(S)-phenyl(2-thienyl)methyl]amino]ethyl] ester Formula: C20H17ClN2O3S MolecularWeight: 400.87858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)COC(=O)C3=CC(=C(C=C3)Cl)N

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](C2=CC=CS2)NC(=O)COC(=O)C3=CC(=C(C=C3)Cl)N

InChI

InChI=1S/C20H17ClN2O3S/c21-15-9-8-14(11-16(15)22)20(25)26-12-18(24)23-19(17-7-4-10-27-17)13-5-2-1-3-6-13/h1-11,19H,12,22H2,(H,23,24)/t19-/m0/s1