2-fluoranyl-N-[(2S)-3-methyl-1-[4-(3-methylphenyl)piperazin-1-yl]-1-oxidanylidene-butan-2-yl]benzenesulfonamide

Systemtic Name: 2-fluoranyl-N-[(2S)-3-methyl-1-[4-(3-methylphenyl)piperazin-1-yl]-1-oxidanylidene-butan-2-yl]benzenesulfonamide Openeye Name: 2-fluoro-N-[(1S)-2-methyl-1-[4-(m-tolyl)piperazine-1-carbonyl]propyl]benzenesulfonamide CAS Name: 2-fluoro-N-[(2S)-3-methyl-1-[4-(3-methylphenyl)-1-piperazinyl]-1-oxobutan-2-yl]benzenesulfonamide IUPAC Name: 2-fluoro-N-[(2S)-3-methyl-1-[4-(3-methylphenyl)piperazin-1-yl]-1-oxobutan-2-yl]benzenesulfonamide Traditional Name: 2-fluoro-N-[(1S)-2-methyl-1-[4-(m-tolyl)piperazine-1-carbonyl]propyl]benzenesulfonamide Formula: C22H28FN3O3S MolecularWeight: 433.539423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C(C(C)C)NS(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)[C@H](C(C)C)NS(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H28FN3O3S/c1-16(2)21(24-30(28,29)20-10-5-4-9-19(20)23)22(27)26-13-11-25(12-14-26)18-8-6-7-17(3)15-18/h4-10,15-16,21,24H,11-14H2,1-3H3/t21-/m0/s1