[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[(phenylmethyl)-(phenylsulfonyl)amino]ethanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[(phenylmethyl)-(phenylsulfonyl)amino]ethanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-[benzenesulfonyl(benzyl)amino]acetate CAS Name: 2-[benzenesulfonyl-(phenylmethyl)amino]acetic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-[benzenesulfonyl(benzyl)amino]acetate Traditional Name: 2-[benzyl(besyl)amino]acetic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C#CCNC(=O)COC(=O)CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H20N2O5S/c1-2-13-21-19(23)16-27-20(24)15-22(14-17-9-5-3-6-10-17)28(25,26)18-11-7-4-8-12-18/h1,3-12H,13-16H2,(H,21,23)