N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]pyridine-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]pyridine-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]pyridine-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-4-pyridinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]pyridine-4-carboxamide Traditional Name: N-homoveratryl-N-[(4-keto-1H-quinazolin-2-yl)methyl]isonicotinamide Formula: C25H24N4O4 MolecularWeight: 444.48246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN(CC2=NC(=O)C3=CC=CC=C3N2)C(=O)C4=CC=NC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN(CC2=NC(=O)C3=CC=CC=C3N2)C(=O)C4=CC=NC=C4)OC

InChI

InChI=1S/C25H24N4O4/c1-32-21-8-7-17(15-22(21)33-2)11-14-29(25(31)18-9-12-26-13-10-18)16-23-27-20-6-4-3-5-19(20)24(30)28-23/h3-10,12-13,15H,11,14,16H2,1-2H3,(H,27,28,30)