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

Systemtic Name: N-[(2R)-2-[(4-chlorophenyl)methyl-(phenylsulfonyl)amino]cyclohexyl]-1-cyclobutylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[(2R)-2-[benzenesulfonyl-[(4-chlorophenyl)methyl]amino]cyclohexyl]-1-(cyclobutanecarbonyl)piperidine-3-carboxamide CAS Name: N-[(2R)-2-[benzenesulfonyl-[(4-chlorophenyl)methyl]amino]cyclohexyl]-1-[cyclobutyl(oxo)methyl]-3-piperidinecarboxamide IUPAC Name: N-[(2R)-2-[benzenesulfonyl-[(4-chlorophenyl)methyl]amino]cyclohexyl]-1-(cyclobutanecarbonyl)piperidine-3-carboxamide Traditional Name: N-[(2R)-2-[besyl-(4-chlorobenzyl)amino]cyclohexyl]-1-(cyclobutanecarbonyl)nipecotamide Formula: C30H38ClN3O4S MolecularWeight: 572.15842

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)NC(=O)C2CCCN(C2)C(=O)C3CCC3)N(CC4=CC=C(C=C4)Cl)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CCC([C@@H](C1)N(CC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3)NC(=O)C4CCCN(C4)C(=O)C5CCC5

InChI

InChI=1S/C30H38ClN3O4S/c31-25-17-15-22(16-18-25)20-34(39(37,38)26-11-2-1-3-12-26)28-14-5-4-13-27(28)32-29(35)24-10-7-19-33(21-24)30(36)23-8-6-9-23/h1-3,11-12,15-18,23-24,27-28H,4-10,13-14,19-21H2,(H,32,35)/t24?,27?,28-/m1/s1