N-(2-morpholin-4-ylpyridin-4-yl)-3-[7-oxidanylidene-2-(propan-2-ylamino)-1H-quinazolin-6-yl]benzamide

Systemtic Name: N-(2-morpholin-4-ylpyridin-4-yl)-3-[7-oxidanylidene-2-(propan-2-ylamino)-1H-quinazolin-6-yl]benzamide Openeye Name: 3-[2-(isopropylamino)-7-oxo-1H-quinazolin-6-yl]-N-(2-morpholino-4-pyridyl)benzamide CAS Name: N-[2-(4-morpholinyl)-4-pyridinyl]-3-[7-oxo-2-(propan-2-ylamino)-1H-quinazolin-6-yl]benzamide IUPAC Name: N-(2-morpholin-4-ylpyridin-4-yl)-3-[7-oxo-2-(propan-2-ylamino)-1H-quinazolin-6-yl]benzamide Traditional Name: 3-[2-(isopropylamino)-7-keto-1H-quinazolin-6-yl]-N-(2-morpholino-4-pyridyl)benzamide Formula: C27H28N6O3 MolecularWeight: 484.54962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=C2C=C(C(=O)C=C2N1)C3=CC(=CC=C3)C(=O)NC4=CC(=NC=C4)N5CCOCC5

Isomeric SMILES

CC(C)NC1=NC=C2C=C(C(=O)C=C2N1)C3=CC(=CC=C3)C(=O)NC4=CC(=NC=C4)N5CCOCC5

InChI

InChI=1S/C27H28N6O3/c1-17(2)30-27-29-16-20-13-22(24(34)15-23(20)32-27)18-4-3-5-19(12-18)26(35)31-21-6-7-28-25(14-21)33-8-10-36-11-9-33/h3-7,12-17H,8-11H2,1-2H3,(H,28,31,35)(H2,29,30,32)