(2-oxidanylidene-2-phenylazanyl-ethyl) 2-[(4-chlorophenyl)sulfonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 2-[(4-chlorophenyl)sulfonylamino]-4-methylsulfanyl-butanoate Openeye Name: (2-anilino-2-oxo-ethyl) 2-[(4-chlorophenyl)sulfonylamino]-4-methylsulfanyl-butanoate CAS Name: 2-[(4-chlorophenyl)sulfonylamino]-4-(methylthio)butanoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 2-[(4-chlorophenyl)sulfonylamino]-4-methylsulfanylbutanoate Traditional Name: 2-[(4-chlorophenyl)sulfonylamino]-4-(methylthio)butyric acid (2-anilino-2-keto-ethyl) ester Formula: C19H21ClN2O5S2 MolecularWeight: 456.96344

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC(=O)NC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CSCCC(C(=O)OCC(=O)NC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H21ClN2O5S2/c1-28-12-11-17(22-29(25,26)16-9-7-14(20)8-10-16)19(24)27-13-18(23)21-15-5-3-2-4-6-15/h2-10,17,22H,11-13H2,1H3,(H,21,23)