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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OC(C)C(=O)NC2=CC=CC=C2C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)O[C@@H](C)C(=O)NC2=CC=CC=C2C#N

InChI

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