2-[4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazin-1-yl]-N-(4-fluorophenyl)-N-methyl-ethanesulfonamide

Systemtic Name: 2-[4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazin-1-yl]-N-(4-fluorophenyl)-N-methyl-ethanesulfonamide Openeye Name: 2-[4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazin-1-yl]-N-(4-fluorophenyl)-N-methyl-ethanesulfonamide CAS Name: 2-[4-(4-cyano-5-methyl-4-phenylhexyl)-1-piperazinyl]-N-(4-fluorophenyl)-N-methylethanesulfonamide IUPAC Name: 2-[4-(4-cyano-5-methyl-4-phenylhexyl)piperazin-1-yl]-N-(4-fluorophenyl)-N-methylethanesulfonamide Traditional Name: 2-[4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazino]-N-(4-fluorophenyl)-N-methyl-ethanesulfonamide Formula: C27H37FN4O2S MolecularWeight: 500.671683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCS(=O)(=O)N(C)C2=CC=C(C=C2)F)(C#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCS(=O)(=O)N(C)C2=CC=C(C=C2)F)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C27H37FN4O2S/c1-23(2)27(22-29,24-8-5-4-6-9-24)14-7-15-31-16-18-32(19-17-31)20-21-35(33,34)30(3)26-12-10-25(28)11-13-26/h4-6,8-13,23H,7,14-21H2,1-3H3