7,8-dimethoxy-4-oxidanylidene-N-(2-pyridin-2-ylethyl)-1H-pyrimido[4,5-b]quinoline-2-carboxamide

Systemtic Name: 7,8-dimethoxy-4-oxidanylidene-N-(2-pyridin-2-ylethyl)-1H-pyrimido[4,5-b]quinoline-2-carboxamide Openeye Name: 7,8-dimethoxy-4-oxo-N-[2-(2-pyridyl)ethyl]-1H-pyrimido[4,5-b]quinoline-2-carboxamide CAS Name: 7,8-dimethoxy-4-oxo-N-[2-(2-pyridinyl)ethyl]-1H-pyrimido[4,5-b]quinoline-2-carboxamide IUPAC Name: 7,8-dimethoxy-4-oxo-N-(2-pyridin-2-ylethyl)-1H-pyrimido[4,5-b]quinoline-2-carboxamide Traditional Name: 4-keto-7,8-dimethoxy-N-[2-(2-pyridyl)ethyl]-1H-pyrimido[4,5-b]quinoline-2-carboxamide Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC3=C(NC(=NC3=O)C(=O)NCCC4=CC=CC=N4)N=C2C=C1OC

Isomeric SMILES

COC1=CC2=CC3=C(NC(=NC3=O)C(=O)NCCC4=CC=CC=N4)N=C2C=C1OC

InChI

InChI=1S/C21H19N5O4/c1-29-16-10-12-9-14-18(24-15(12)11-17(16)30-2)25-19(26-20(14)27)21(28)23-8-6-13-5-3-4-7-22-13/h3-5,7,9-11H,6,8H2,1-2H3,(H,23,28)(H,24,25,26,27)