N-(3-chloranyl-4-methyl-phenyl)-1-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-1-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-1-[6-(1-piperidylsulfonyl)-2-quinolyl]piperidine-3-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-1-[6-(1-piperidinylsulfonyl)-2-quinolinyl]-3-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-1-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-1-(6-piperidinosulfonyl-2-quinolyl)nipecotamide Formula: C27H31ClN4O3S MolecularWeight: 527.07804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)C3=NC4=C(C=C3)C=C(C=C4)S(=O)(=O)N5CCCCC5)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)C3=NC4=C(C=C3)C=C(C=C4)S(=O)(=O)N5CCCCC5)Cl

InChI

InChI=1S/C27H31ClN4O3S/c1-19-7-9-22(17-24(19)28)29-27(33)21-6-5-13-31(18-21)26-12-8-20-16-23(10-11-25(20)30-26)36(34,35)32-14-3-2-4-15-32/h7-12,16-17,21H,2-6,13-15,18H2,1H3,(H,29,33)