[1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(phenylsulfonylamino)ethanoate

Systemtic Name: [1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(phenylsulfonylamino)ethanoate Openeye Name: [2-(3-cyanoanilino)-1-methyl-2-oxo-ethyl] 2-(benzenesulfonamido)acetate CAS Name: 2-(benzenesulfonamido)acetic acid [1-(3-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-cyanoanilino)-1-oxopropan-2-yl] 2-(benzenesulfonamido)acetate Traditional Name: 2-(benzenesulfonamido)acetic acid [2-(3-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C#N)OC(=O)CNS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C#N)OC(=O)CNS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H17N3O5S/c1-13(18(23)21-15-7-5-6-14(10-15)11-19)26-17(22)12-20-27(24,25)16-8-3-2-4-9-16/h2-10,13,20H,12H2,1H3,(H,21,23)