1-(4-acetamidophenyl)sulfonyl-N-[(2R)-2-[(2-methylphenyl)carbonylamino]cyclohexyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-acetamidophenyl)sulfonyl-N-[(2R)-2-[(2-methylphenyl)carbonylamino]cyclohexyl]piperidine-3-carboxamide Openeye Name: 1-(4-acetamidophenyl)sulfonyl-N-[(2R)-2-[(2-methylbenzoyl)amino]cyclohexyl]piperidine-3-carboxamide CAS Name: 1-(4-acetamidophenyl)sulfonyl-N-[(2R)-2-[[(2-methylphenyl)-oxomethyl]amino]cyclohexyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-acetamidophenyl)sulfonyl-N-[(2R)-2-[(2-methylbenzoyl)amino]cyclohexyl]piperidine-3-carboxamide Traditional Name: 1-(4-acetamidophenyl)sulfonyl-N-[(2R)-2-(o-toluoylamino)cyclohexyl]nipecotamide Formula: C28H36N4O5S MolecularWeight: 540.67424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2CCCCC2NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)N[C@@H]2CCCCC2NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C28H36N4O5S/c1-19-8-3-4-10-24(19)28(35)31-26-12-6-5-11-25(26)30-27(34)21-9-7-17-32(18-21)38(36,37)23-15-13-22(14-16-23)29-20(2)33/h3-4,8,10,13-16,21,25-26H,5-7,9,11-12,17-18H2,1-2H3,(H,29,33)(H,30,34)(H,31,35)/t21?,25?,26-/m1/s1