4-[4-(2-cyclopentyloxy-5-methylsulfonyl-phenyl)carbonylpiperazin-1-yl]benzenecarbonitrile

Systemtic Name: 4-[4-(2-cyclopentyloxy-5-methylsulfonyl-phenyl)carbonylpiperazin-1-yl]benzenecarbonitrile Openeye Name: 4-[4-[2-(cyclopentoxy)-5-methylsulfonyl-benzoyl]piperazin-1-yl]benzonitrile CAS Name: 4-[4-[(2-cyclopentyloxy-5-methylsulfonylphenyl)-oxomethyl]-1-piperazinyl]benzonitrile IUPAC Name: 4-[4-(2-cyclopentyloxy-5-methylsulfonylbenzoyl)piperazin-1-yl]benzonitrile Traditional Name: 4-[4-[2-(cyclopentoxy)-5-mesyl-benzoyl]piperazino]benzonitrile Formula: C24H27N3O4S MolecularWeight: 453.55388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)OC2CCCC2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)OC2CCCC2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H27N3O4S/c1-32(29,30)21-10-11-23(31-20-4-2-3-5-20)22(16-21)24(28)27-14-12-26(13-15-27)19-8-6-18(17-25)7-9-19/h6-11,16,20H,2-5,12-15H2,1H3