3-[4-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)butanoylamino]benzamide

Systemtic Name: 3-[4-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)butanoylamino]benzamide Openeye Name: 3-[4-(6,7-dimethoxy-4-oxo-quinazolin-3-yl)butanoylamino]benzamide CAS Name: 3-[[4-(6,7-dimethoxy-4-oxo-3-quinazolinyl)-1-oxobutyl]amino]benzamide IUPAC Name: 3-[4-(6,7-dimethoxy-4-oxoquinazolin-3-yl)butanoylamino]benzamide Traditional Name: 3-[4-(4-keto-6,7-dimethoxy-quinazolin-3-yl)butanoylamino]benzamide Formula: C21H22N4O5 MolecularWeight: 410.42318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NC3=CC=CC(=C3)C(=O)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NC3=CC=CC(=C3)C(=O)N)OC

InChI

InChI=1S/C21H22N4O5/c1-29-17-10-15-16(11-18(17)30-2)23-12-25(21(15)28)8-4-7-19(26)24-14-6-3-5-13(9-14)20(22)27/h3,5-6,9-12H,4,7-8H2,1-2H3,(H2,22,27)(H,24,26)