[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-[(2-cyanophenyl)sulfonylamino]ethanoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-[(2-cyanophenyl)sulfonylamino]ethanoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 2-[(2-cyanophenyl)sulfonylamino]acetate CAS Name: 2-[(2-cyanophenyl)sulfonylamino]acetic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 2-[(2-cyanophenyl)sulfonylamino]acetate Traditional Name: 2-[(2-cyanophenyl)sulfonylamino]acetic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C16H21N3O5S MolecularWeight: 367.42004

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)CNS(=O)(=O)C1=CC=CC=C1C#N

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)CNS(=O)(=O)C1=CC=CC=C1C#N

InChI

InChI=1S/C16H21N3O5S/c1-3-13(4-2)19-15(20)11-24-16(21)10-18-25(22,23)14-8-6-5-7-12(14)9-17/h5-8,13,18H,3-4,10-11H2,1-2H3,(H,19,20)