N-(2,5-dimethylphenyl)-1-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide

Systemtic Name: N-(2,5-dimethylphenyl)-1-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide Openeye Name: N-(2,5-dimethylphenyl)-1-[6-(1-piperidylsulfonyl)-2-quinolyl]piperidine-3-carboxamide CAS Name: N-(2,5-dimethylphenyl)-1-[6-(1-piperidinylsulfonyl)-2-quinolinyl]-3-piperidinecarboxamide IUPAC Name: N-(2,5-dimethylphenyl)-1-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide Traditional Name: N-(2,5-dimethylphenyl)-1-(6-piperidinosulfonyl-2-quinolyl)nipecotamide Formula: C28H34N4O3S MolecularWeight: 506.65956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H34N4O3S/c1-20-8-9-21(2)26(17-20)30-28(33)23-7-6-14-31(19-23)27-13-10-22-18-24(11-12-25(22)29-27)36(34,35)32-15-4-3-5-16-32/h8-13,17-18,23H,3-7,14-16,19H2,1-2H3,(H,30,33)