N-[(2S)-butan-2-yl]-4-[[(1-methylpyrrol-2-yl)carbonylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N-[(2S)-butan-2-yl]-4-[[(1-methylpyrrol-2-yl)carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: N-[(1S)-1-methylpropyl]-4-[[(1-methylpyrrole-2-carbonyl)amino]carbamoyl]benzenesulfonamide CAS Name: N-[(2S)-butan-2-yl]-4-[[[(1-methyl-2-pyrrolyl)-oxomethyl]hydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: N-[(2S)-butan-2-yl]-4-[[(1-methylpyrrole-2-carbonyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N-[(1S)-1-methylpropyl]-4-[[(1-methylpyrrole-2-carbonyl)amino]carbamoyl]benzenesulfonamide Formula: C17H22N4O4S MolecularWeight: 378.44598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=CN2C

Isomeric SMILES

CC[C@H](C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=CN2C

InChI

InChI=1S/C17H22N4O4S/c1-4-12(2)20-26(24,25)14-9-7-13(8-10-14)16(22)18-19-17(23)15-6-5-11-21(15)3/h5-12,20H,4H2,1-3H3,(H,18,22)(H,19,23)/t12-/m0/s1