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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2CCN(CC2)C3=NC4=C(C=C3)C=C(C=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2CCN(CC2)C3=NC4=C(C=C3)C=C(C=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C27H38N4O3S/c32-27(28-23-8-4-1-2-5-9-23)21-14-18-30(19-15-21)26-13-10-22-20-24(11-12-25(22)29-26)35(33,34)31-16-6-3-7-17-31/h10-13,20-21,23H,1-9,14-19H2,(H,28,32)