N-[2-(cyclohexylcarbamoyl)phenyl]-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-[2-(cyclohexylcarbamoyl)phenyl]-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-[2-(cyclohexylcarbamoyl)phenyl]-1-(o-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-[(cyclohexylamino)-oxomethyl]phenyl]-1-[(2-methylphenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(cyclohexylcarbamoyl)phenyl]-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-[2-(cyclohexylcarbamoyl)phenyl]-1-(2-methylbenzyl)sulfonyl-isonipecotamide Formula: C27H35N3O4S MolecularWeight: 497.6495

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CS(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3C(=O)NC4CCCCC4

Isomeric SMILES

CC1=CC=CC=C1CS(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3C(=O)NC4CCCCC4

InChI

InChI=1S/C27H35N3O4S/c1-20-9-5-6-10-22(20)19-35(33,34)30-17-15-21(16-18-30)26(31)29-25-14-8-7-13-24(25)27(32)28-23-11-3-2-4-12-23/h5-10,13-14,21,23H,2-4,11-12,15-19H2,1H3,(H,28,32)(H,29,31)