(4-ethanoylphenyl) (2S)-2-[(2-chlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (4-ethanoylphenyl) (2S)-2-[(2-chlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (4-acetylphenyl) (2S)-2-[(2-chlorobenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(2-chlorophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) (2S)-2-[(2-chlorobenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(2-chlorobenzoyl)amino]-4-(methylthio)butyric acid (4-acetylphenyl) ester Formula: C20H20ClNO4S MolecularWeight: 405.8951

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)[C@H](CCSC)NC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C20H20ClNO4S/c1-13(23)14-7-9-15(10-8-14)26-20(25)18(11-12-27-2)22-19(24)16-5-3-4-6-17(16)21/h3-10,18H,11-12H2,1-2H3,(H,22,24)/t18-/m0/s1