1-[4-[1-(4-cyano-3-methyl-phenyl)hexyl]piperazin-1-yl]-N-(4-fluorophenyl)-N-methyl-ethanesulfonamide

Systemtic Name: 1-[4-[1-(4-cyano-3-methyl-phenyl)hexyl]piperazin-1-yl]-N-(4-fluorophenyl)-N-methyl-ethanesulfonamide Openeye Name: 1-[4-[1-(4-cyano-3-methyl-phenyl)hexyl]piperazin-1-yl]-N-(4-fluorophenyl)-N-methyl-ethanesulfonamide CAS Name: 1-[4-[1-(4-cyano-3-methylphenyl)hexyl]-1-piperazinyl]-N-(4-fluorophenyl)-N-methylethanesulfonamide IUPAC Name: 1-[4-[1-(4-cyano-3-methylphenyl)hexyl]piperazin-1-yl]-N-(4-fluorophenyl)-N-methylethanesulfonamide Traditional Name: 1-[4-[1-(4-cyano-3-methyl-phenyl)hexyl]piperazino]-N-(4-fluorophenyl)-N-methyl-ethanesulfonamide Formula: C27H37FN4O2S MolecularWeight: 500.671683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC(=C(C=C1)C#N)C)N2CCN(CC2)C(C)S(=O)(=O)N(C)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCCC(C1=CC(=C(C=C1)C#N)C)N2CCN(CC2)C(C)S(=O)(=O)N(C)C3=CC=C(C=C3)F

InChI

InChI=1S/C27H37FN4O2S/c1-5-6-7-8-27(23-9-10-24(20-29)21(2)19-23)32-17-15-31(16-18-32)22(3)35(33,34)30(4)26-13-11-25(28)12-14-26/h9-14,19,22,27H,5-8,15-18H2,1-4H3