N-[3-fluoranyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]phenyl]pentanamide

Systemtic Name: N-[3-fluoranyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]phenyl]pentanamide Openeye Name: N-[3-fluoro-4-[4-(p-tolylsulfonyl)piperazin-1-yl]phenyl]pentanamide CAS Name: N-[3-fluoro-4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]phenyl]pentanamide IUPAC Name: N-[3-fluoro-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]phenyl]pentanamide Traditional Name: N-[3-fluoro-4-(4-tosylpiperazino)phenyl]valeramide Formula: C22H28FN3O3S MolecularWeight: 433.539423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)F

Isomeric SMILES

CCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)F

InChI

InChI=1S/C22H28FN3O3S/c1-3-4-5-22(27)24-18-8-11-21(20(23)16-18)25-12-14-26(15-13-25)30(28,29)19-9-6-17(2)7-10-19/h6-11,16H,3-5,12-15H2,1-2H3,(H,24,27)