N-(4-oxidanylidene-2-pyrimidin-4-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl)isoquinoline-1-carboxamide

Systemtic Name: N-(4-oxidanylidene-2-pyrimidin-4-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl)isoquinoline-1-carboxamide Openeye Name: N-(4-oxo-2-pyrimidin-4-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl)isoquinoline-1-carboxamide CAS Name: N-[4-oxo-2-(4-pyrimidinyl)-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl]-1-isoquinolinecarboxamide IUPAC Name: N-(4-oxo-2-pyrimidin-4-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl)isoquinoline-1-carboxamide Traditional Name: N-[4-keto-2-(4-pyrimidyl)-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl]isoquinoline-1-carboxamide Formula: C22H18N6O2 MolecularWeight: 398.41732

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=NC(=CC(=O)N2C1)C3=NC=NC=C3)NC(=O)C4=NC=CC5=CC=CC=C54

Isomeric SMILES

C1CC(C2=NC(=CC(=O)N2C1)C3=NC=NC=C3)NC(=O)C4=NC=CC5=CC=CC=C54

InChI

InChI=1S/C22H18N6O2/c29-19-12-18(16-8-9-23-13-25-16)26-21-17(6-3-11-28(19)21)27-22(30)20-15-5-2-1-4-14(15)7-10-24-20/h1-2,4-5,7-10,12-13,17H,3,6,11H2,(H,27,30)