1-methylsulfonyl-N-(5-piperidin-1-ylisoquinolin-8-yl)piperidine-4-carboxamide

Systemtic Name: 1-methylsulfonyl-N-(5-piperidin-1-ylisoquinolin-8-yl)piperidine-4-carboxamide Openeye Name: 1-methylsulfonyl-N-[5-(1-piperidyl)-8-isoquinolyl]piperidine-4-carboxamide CAS Name: 1-methylsulfonyl-N-[5-(1-piperidinyl)-8-isoquinolinyl]-4-piperidinecarboxamide IUPAC Name: 1-methylsulfonyl-N-(5-piperidin-1-ylisoquinolin-8-yl)piperidine-4-carboxamide Traditional Name: 1-mesyl-N-(5-piperidino-8-isoquinolyl)isonipecotamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4

InChI

InChI=1S/C21H28N4O3S/c1-29(27,28)25-13-8-16(9-14-25)21(26)23-19-5-6-20(24-11-3-2-4-12-24)17-7-10-22-15-18(17)19/h5-7,10,15-16H,2-4,8-9,11-14H2,1H3,(H,23,26)