[(2S)-1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-[(4-cyanophenyl)sulfonylamino]ethanoate

Systemtic Name: [(2S)-1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-[(4-cyanophenyl)sulfonylamino]ethanoate Openeye Name: [(1S)-1-methyl-2-(2-methylanilino)-2-oxo-ethyl] 2-[(4-cyanophenyl)sulfonylamino]acetate CAS Name: 2-[(4-cyanophenyl)sulfonylamino]acetic acid [(2S)-1-(2-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-methylanilino)-1-oxopropan-2-yl] 2-[(4-cyanophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-cyanophenyl)sulfonylamino]acetic acid [(1S)-2-keto-1-methyl-2-(o-toluidino)ethyl] ester Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)OC(=O)CNS(=O)(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)[C@H](C)OC(=O)CNS(=O)(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H19N3O5S/c1-13-5-3-4-6-17(13)22-19(24)14(2)27-18(23)12-21-28(25,26)16-9-7-15(11-20)8-10-16/h3-10,14,21H,12H2,1-2H3,(H,22,24)/t14-/m0/s1