N-(4-methylcyclohexyl)-1-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide

Systemtic Name: N-(4-methylcyclohexyl)-1-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide Openeye Name: N-(4-methylcyclohexyl)-1-[6-(1-piperidylsulfonyl)-2-quinolyl]piperidine-3-carboxamide CAS Name: N-(4-methylcyclohexyl)-1-[6-(1-piperidinylsulfonyl)-2-quinolinyl]-3-piperidinecarboxamide IUPAC Name: N-(4-methylcyclohexyl)-1-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide Traditional Name: N-(4-methylcyclohexyl)-1-(6-piperidinosulfonyl-2-quinolyl)nipecotamide Formula: C27H38N4O3S MolecularWeight: 498.68062

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)C2CCCN(C2)C3=NC4=C(C=C3)C=C(C=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CC1CCC(CC1)NC(=O)C2CCCN(C2)C3=NC4=C(C=C3)C=C(C=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C27H38N4O3S/c1-20-7-10-23(11-8-20)28-27(32)22-6-5-15-30(19-22)26-14-9-21-18-24(12-13-25(21)29-26)35(33,34)31-16-3-2-4-17-31/h9,12-14,18,20,22-23H,2-8,10-11,15-17,19H2,1H3,(H,28,32)