N-[1-[4-(2-fluorophenyl)piperazin-1-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[1-[4-(2-fluorophenyl)piperazin-1-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[1-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-methyl-butyl]-4-methyl-benzenesulfonamide CAS Name: N-[1-[4-(2-fluorophenyl)-1-piperazinyl]-4-methyl-1-oxopentan-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[1-[4-(2-fluorophenyl)piperazin-1-yl]-4-methyl-1-oxopentan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[1-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-methyl-butyl]-4-methyl-benzenesulfonamide Formula: C23H30FN3O3S MolecularWeight: 447.566003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30FN3O3S/c1-17(2)16-21(25-31(29,30)19-10-8-18(3)9-11-19)23(28)27-14-12-26(13-15-27)22-7-5-4-6-20(22)24/h4-11,17,21,25H,12-16H2,1-3H3