4-[(2Z)-2-[6,7-dimethoxy-4-(2-pyridin-4-ylethylamino)-1H-quinazolin-2-ylidene]ethylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[(2Z)-2-[6,7-dimethoxy-4-(2-pyridin-4-ylethylamino)-1H-quinazolin-2-ylidene]ethylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[(2Z)-2-[6,7-dimethoxy-4-[2-(4-pyridyl)ethylamino]-1H-quinazolin-2-ylidene]ethylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[(2Z)-2-[6,7-dimethoxy-4-(2-pyridin-4-ylethylamino)-1H-quinazolin-2-ylidene]ethylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[(2Z)-2-[6,7-dimethoxy-4-(2-pyridin-4-ylethylamino)-1H-quinazolin-2-ylidene]ethylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[(2Z)-2-[6,7-dimethoxy-4-[2-(4-pyridyl)ethylamino]-1H-quinazolin-2-ylidene]ethylidene]cyclohexa-2,5-dien-1-one Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=CC=C3C=CC(=O)C=C3)N2)NCCC4=CC=NC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=N/C(=C\C=C3C=CC(=O)C=C3)/N2)NCCC4=CC=NC=C4)OC

InChI

InChI=1S/C25H24N4O3/c1-31-22-15-20-21(16-23(22)32-2)28-24(8-5-17-3-6-19(30)7-4-17)29-25(20)27-14-11-18-9-12-26-13-10-18/h3-10,12-13,15-16,28H,11,14H2,1-2H3,(H,27,29)/b24-8-