[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 4-[[(2R)-butan-2-yl]sulfamoyl]benzoate

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 4-[[(2R)-butan-2-yl]sulfamoyl]benzoate Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl] 4-[[(1R)-1-methylpropyl]sulfamoyl]benzoate CAS Name: 4-[[(2R)-butan-2-yl]sulfamoyl]benzoic acid [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 4-[[(2R)-butan-2-yl]sulfamoyl]benzoate Traditional Name: 4-[[(1R)-1-methylpropyl]sulfamoyl]benzoic acid [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl] ester Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NC2(CCCC2)C#N

Isomeric SMILES

CC[C@@H](C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NC2(CCCC2)C#N

InChI

InChI=1S/C19H25N3O5S/c1-3-14(2)22-28(25,26)16-8-6-15(7-9-16)18(24)27-12-17(23)21-19(13-20)10-4-5-11-19/h6-9,14,22H,3-5,10-12H2,1-2H3,(H,21,23)/t14-/m1/s1