N-(4-chlorophenyl)-N-methyl-1-(4-pyridin-2-ylpiperazin-1-yl)isoquinoline-4-carboxamide

Systemtic Name: N-(4-chlorophenyl)-N-methyl-1-(4-pyridin-2-ylpiperazin-1-yl)isoquinoline-4-carboxamide Openeye Name: N-(4-chlorophenyl)-N-methyl-1-[4-(2-pyridyl)piperazin-1-yl]isoquinoline-4-carboxamide CAS Name: N-(4-chlorophenyl)-N-methyl-1-[4-(2-pyridinyl)-1-piperazinyl]-4-isoquinolinecarboxamide IUPAC Name: N-(4-chlorophenyl)-N-methyl-1-(4-pyridin-2-ylpiperazin-1-yl)isoquinoline-4-carboxamide Traditional Name: N-(4-chlorophenyl)-N-methyl-1-[4-(2-pyridyl)piperazino]isoquinoline-4-carboxamide Formula: C26H24ClN5O MolecularWeight: 457.95466

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)Cl)C(=O)C2=CN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CN(C1=CC=C(C=C1)Cl)C(=O)C2=CN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C26H24ClN5O/c1-30(20-11-9-19(27)10-12-20)26(33)23-18-29-25(22-7-3-2-6-21(22)23)32-16-14-31(15-17-32)24-8-4-5-13-28-24/h2-13,18H,14-17H2,1H3