N-[(2S)-butan-2-yl]-4-[[2-(4-fluorophenyl)ethanoylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N-[(2S)-butan-2-yl]-4-[[2-(4-fluorophenyl)ethanoylamino]carbamoyl]benzenesulfonamide Openeye Name: 4-[[[2-(4-fluorophenyl)acetyl]amino]carbamoyl]-N-[(1S)-1-methylpropyl]benzenesulfonamide CAS Name: N-[(2S)-butan-2-yl]-4-[[[2-(4-fluorophenyl)-1-oxoethyl]hydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: N-[(2S)-butan-2-yl]-4-[[[2-(4-fluorophenyl)acetyl]amino]carbamoyl]benzenesulfonamide Traditional Name: 4-[[[2-(4-fluorophenyl)acetyl]amino]carbamoyl]-N-[(1S)-1-methylpropyl]benzenesulfonamide Formula: C19H22FN3O4S MolecularWeight: 407.459083

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)CC2=CC=C(C=C2)F

Isomeric SMILES

CC[C@H](C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)CC2=CC=C(C=C2)F

InChI

InChI=1S/C19H22FN3O4S/c1-3-13(2)23-28(26,27)17-10-6-15(7-11-17)19(25)22-21-18(24)12-14-4-8-16(20)9-5-14/h4-11,13,23H,3,12H2,1-2H3,(H,21,24)(H,22,25)/t13-/m0/s1