N-[(2R)-2-[(4-chlorophenyl)methyl-(phenylsulfonyl)amino]cyclohexyl]-1-ethanoyl-piperidine-3-carboxamide

Systemtic Name: N-[(2R)-2-[(4-chlorophenyl)methyl-(phenylsulfonyl)amino]cyclohexyl]-1-ethanoyl-piperidine-3-carboxamide Openeye Name: 1-acetyl-N-[(2R)-2-[benzenesulfonyl-[(4-chlorophenyl)methyl]amino]cyclohexyl]piperidine-3-carboxamide CAS Name: 1-acetyl-N-[(2R)-2-[benzenesulfonyl-[(4-chlorophenyl)methyl]amino]cyclohexyl]-3-piperidinecarboxamide IUPAC Name: 1-acetyl-N-[(2R)-2-[benzenesulfonyl-[(4-chlorophenyl)methyl]amino]cyclohexyl]piperidine-3-carboxamide Traditional Name: 1-acetyl-N-[(2R)-2-[besyl-(4-chlorobenzyl)amino]cyclohexyl]nipecotamide Formula: C27H34ClN3O4S MolecularWeight: 532.09456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC(C1)C(=O)NC2CCCCC2N(CC3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCCC(C1)C(=O)NC2CCCC[C@H]2N(CC3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H34ClN3O4S/c1-20(32)30-17-7-8-22(19-30)27(33)29-25-11-5-6-12-26(25)31(18-21-13-15-23(28)16-14-21)36(34,35)24-9-3-2-4-10-24/h2-4,9-10,13-16,22,25-26H,5-8,11-12,17-19H2,1H3,(H,29,33)/t22?,25?,26-/m1/s1