2-fluoranyl-N-[1-[4-(3-methylbutanoyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]benzenesulfonamide

Systemtic Name: 2-fluoranyl-N-[1-[4-(3-methylbutanoyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]benzenesulfonamide Openeye Name: N-[1-benzyl-2-[4-(3-methylbutanoyl)piperazin-1-yl]-2-oxo-ethyl]-2-fluoro-benzenesulfonamide CAS Name: 2-fluoro-N-[1-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]-1-oxo-3-phenylpropan-2-yl]benzenesulfonamide IUPAC Name: 2-fluoro-N-[1-[4-(3-methylbutanoyl)piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]benzenesulfonamide Traditional Name: N-[1-benzyl-2-(4-isovalerylpiperazino)-2-keto-ethyl]-2-fluoro-benzenesulfonamide Formula: C24H30FN3O4S MolecularWeight: 475.576103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)C(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)C(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C24H30FN3O4S/c1-18(2)16-23(29)27-12-14-28(15-13-27)24(30)21(17-19-8-4-3-5-9-19)26-33(31,32)22-11-7-6-10-20(22)25/h3-11,18,21,26H,12-17H2,1-2H3