N-(5-chloranyl-2-methoxy-phenyl)-1-(4-pyridin-2-ylpiperazin-1-yl)isoquinoline-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-1-(4-pyridin-2-ylpiperazin-1-yl)isoquinoline-4-carboxamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-1-[4-(2-pyridyl)piperazin-1-yl]isoquinoline-4-carboxamide CAS Name: N-(5-chloro-2-methoxyphenyl)-1-[4-(2-pyridinyl)-1-piperazinyl]-4-isoquinolinecarboxamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-1-(4-pyridin-2-ylpiperazin-1-yl)isoquinoline-4-carboxamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-1-[4-(2-pyridyl)piperazino]isoquinoline-4-carboxamide Formula: C26H24ClN5O2 MolecularWeight: 473.95406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)C2=CN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)C2=CN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C26H24ClN5O2/c1-34-23-10-9-18(27)16-22(23)30-26(33)21-17-29-25(20-7-3-2-6-19(20)21)32-14-12-31(13-15-32)24-8-4-5-11-28-24/h2-11,16-17H,12-15H2,1H3,(H,30,33)