[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 3-(phenylcarbamoylamino)propanoate

Systemtic Name: [2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 3-(phenylcarbamoylamino)propanoate Openeye Name: [2-(3-methylsulfonylanilino)-2-oxo-ethyl] 3-(phenylcarbamoylamino)propanoate CAS Name: 3-[[anilino(oxo)methyl]amino]propanoic acid [2-(3-methylsulfonylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylsulfonylanilino)-2-oxoethyl] 3-(phenylcarbamoylamino)propanoate Traditional Name: 3-(phenylcarbamoylamino)propionic acid [2-keto-2-(3-mesylanilino)ethyl] ester Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)COC(=O)CCNC(=O)NC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)COC(=O)CCNC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C19H21N3O6S/c1-29(26,27)16-9-5-8-15(12-16)21-17(23)13-28-18(24)10-11-20-19(25)22-14-6-3-2-4-7-14/h2-9,12H,10-11,13H2,1H3,(H,21,23)(H2,20,22,25)