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

Systemtic Name: N-[(2R)-2-[(4-chlorophenyl)methyl-(phenylsulfonyl)amino]cyclohexyl]-1-hexanoyl-piperidine-3-carboxamide Openeye Name: N-[(2R)-2-[benzenesulfonyl-[(4-chlorophenyl)methyl]amino]cyclohexyl]-1-hexanoyl-piperidine-3-carboxamide CAS Name: N-[(2R)-2-[benzenesulfonyl-[(4-chlorophenyl)methyl]amino]cyclohexyl]-1-(1-oxohexyl)-3-piperidinecarboxamide IUPAC Name: N-[(2R)-2-[benzenesulfonyl-[(4-chlorophenyl)methyl]amino]cyclohexyl]-1-hexanoylpiperidine-3-carboxamide Traditional Name: N-[(2R)-2-[besyl-(4-chlorobenzyl)amino]cyclohexyl]-1-caproyl-nipecotamide Formula: C31H42ClN3O4S MolecularWeight: 588.20088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCC(=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/C31H42ClN3O4S/c1-2-3-5-16-30(36)34-21-10-11-25(23-34)31(37)33-28-14-8-9-15-29(28)35(22-24-17-19-26(32)20-18-24)40(38,39)27-12-6-4-7-13-27/h4,6-7,12-13,17-20,25,28-29H,2-3,5,8-11,14-16,21-23H2,1H3,(H,33,37)/t25?,28?,29-/m1/s1