N-(2-cyclobutyl-6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)-3-fluoranyl-benzamide hydrochloride

Systemtic Name: N-(2-cyclobutyl-6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)-3-fluoranyl-benzamide hydrochloride Openeye Name: N-(2-cyclobutyl-6,7-dimethoxy-4-oxo-quinazolin-3-yl)-3-fluoro-benzamide hydrochloride CAS Name: N-(2-cyclobutyl-6,7-dimethoxy-4-oxo-3-quinazolinyl)-3-fluorobenzamide hydrochloride IUPAC Name: N-(2-cyclobutyl-6,7-dimethoxy-4-oxoquinazolin-3-yl)-3-fluorobenzamide hydrochloride Traditional Name: N-(2-cyclobutyl-4-keto-6,7-dimethoxy-quinazolin-3-yl)-3-fluoro-benzamide hydrochloride Formula: C21H21ClFN3O4 MolecularWeight: 433.860543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C(=N2)C3CCC3)NC(=O)C4=CC(=CC=C4)F)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C(=N2)C3CCC3)NC(=O)C4=CC(=CC=C4)F)OC.Cl

InChI

InChI=1S/C21H20FN3O4.ClH/c1-28-17-10-15-16(11-18(17)29-2)23-19(12-5-3-6-12)25(21(15)27)24-20(26)13-7-4-8-14(22)9-13;/h4,7-12H,3,5-6H2,1-2H3,(H,24,26);1H