[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxidanylidene-ethyl] 2-[(2-cyanophenyl)sulfonylamino]ethanoate

Systemtic Name: [2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxidanylidene-ethyl] 2-[(2-cyanophenyl)sulfonylamino]ethanoate Openeye Name: [2-[[(1S)-1,2-dimethylpropyl]amino]-2-oxo-ethyl] 2-[(2-cyanophenyl)sulfonylamino]acetate CAS Name: 2-[(2-cyanophenyl)sulfonylamino]acetic acid [2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxoethyl] 2-[(2-cyanophenyl)sulfonylamino]acetate Traditional Name: 2-[(2-cyanophenyl)sulfonylamino]acetic acid [2-[[(1S)-1,2-dimethylpropyl]amino]-2-keto-ethyl] ester Formula: C16H21N3O5S MolecularWeight: 367.42004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(C)C)NC(=O)COC(=O)CNS(=O)(=O)C1=CC=CC=C1C#N

InChI

InChI=1S/C16H21N3O5S/c1-11(2)12(3)19-15(20)10-24-16(21)9-18-25(22,23)14-7-5-4-6-13(14)8-17/h4-7,11-12,18H,9-10H2,1-3H3,(H,19,20)/t12-/m0/s1