N-[2-[4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazin-1-yl]ethyl]-N-(phenylmethyl)methanesulfonamide

Systemtic Name: N-[2-[4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazin-1-yl]ethyl]-N-(phenylmethyl)methanesulfonamide Openeye Name: N-benzyl-N-[2-[4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazin-1-yl]ethyl]methanesulfonamide CAS Name: N-[2-[4-(4-cyano-5-methyl-4-phenylhexyl)-1-piperazinyl]ethyl]-N-(phenylmethyl)methanesulfonamide IUPAC Name: N-benzyl-N-[2-[4-(4-cyano-5-methyl-4-phenylhexyl)piperazin-1-yl]ethyl]methanesulfonamide Traditional Name: N-benzyl-N-[2-[4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazino]ethyl]methanesulfonamide Formula: C28H40N4O2S MolecularWeight: 496.7078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCN(CC2=CC=CC=C2)S(=O)(=O)C)(C#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCN(CC2=CC=CC=C2)S(=O)(=O)C)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C28H40N4O2S/c1-25(2)28(24-29,27-13-8-5-9-14-27)15-10-16-30-17-19-31(20-18-30)21-22-32(35(3,33)34)23-26-11-6-4-7-12-26/h4-9,11-14,25H,10,15-23H2,1-3H3