1-oxidanylidene-N-(4-piperidin-1-ylpiperidin-1-yl)sulfonyl-2H-isoquinoline-4-carboxamide

Systemtic Name: 1-oxidanylidene-N-(4-piperidin-1-ylpiperidin-1-yl)sulfonyl-2H-isoquinoline-4-carboxamide Openeye Name: 1-oxo-N-[[4-(1-piperidyl)-1-piperidyl]sulfonyl]-2H-isoquinoline-4-carboxamide CAS Name: 1-oxo-N-[[4-(1-piperidinyl)-1-piperidinyl]sulfonyl]-2H-isoquinoline-4-carboxamide IUPAC Name: 1-oxo-N-(4-piperidin-1-ylpiperidin-1-yl)sulfonyl-2H-isoquinoline-4-carboxamide Traditional Name: 1-keto-N-(4-piperidinopiperidino)sulfonyl-2H-isoquinoline-4-carboxamide Formula: C20H26N4O4S MolecularWeight: 418.50984

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)S(=O)(=O)NC(=O)C3=CNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)S(=O)(=O)NC(=O)C3=CNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C20H26N4O4S/c25-19-17-7-3-2-6-16(17)18(14-21-19)20(26)22-29(27,28)24-12-8-15(9-13-24)23-10-4-1-5-11-23/h2-3,6-7,14-15H,1,4-5,8-13H2,(H,21,25)(H,22,26)