N-[2-(4-cyclopentylpiperazin-1-yl)pyridin-4-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-[2-(4-cyclopentylpiperazin-1-yl)pyridin-4-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[2-(4-cyclopentylpiperazin-1-yl)-4-pyridyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-[2-(4-cyclopentyl-1-piperazinyl)-4-pyridinyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-[2-(4-cyclopentylpiperazin-1-yl)pyridin-4-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[2-(4-cyclopentylpiperazino)-4-pyridyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C24H31N5O MolecularWeight: 405.53584

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCN(CC2)C3=NC=CC(=C3)NC(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CCC(C1)N2CCN(CC2)C3=NC=CC(=C3)NC(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C24H31N5O/c30-24(29-12-10-19-5-1-2-6-20(19)18-29)26-21-9-11-25-23(17-21)28-15-13-27(14-16-28)22-7-3-4-8-22/h1-2,5-6,9,11,17,22H,3-4,7-8,10,12-16,18H2,(H,25,26,30)