(E)-N-(4-imidazol-1-ylbutyl)-3-(6-oxidanyl-4-oxidanylidene-quinazolin-3-yl)prop-2-enamide

Systemtic Name: (E)-N-(4-imidazol-1-ylbutyl)-3-(6-oxidanyl-4-oxidanylidene-quinazolin-3-yl)prop-2-enamide Openeye Name: (E)-3-(6-hydroxy-4-oxo-quinazolin-3-yl)-N-(4-imidazol-1-ylbutyl)prop-2-enamide CAS Name: (E)-3-(6-hydroxy-4-oxo-3-quinazolinyl)-N-[4-(1-imidazolyl)butyl]-2-propenamide IUPAC Name: (E)-3-(6-hydroxy-4-oxoquinazolin-3-yl)-N-(4-imidazol-1-ylbutyl)prop-2-enamide Traditional Name: (E)-3-(6-hydroxy-4-keto-quinazolin-3-yl)-N-(4-imidazol-1-ylbutyl)acrylamide Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)C(=O)N(C=N2)C=CC(=O)NCCCCN3C=CN=C3

Isomeric SMILES

C1=CC2=C(C=C1O)C(=O)N(C=N2)/C=C/C(=O)NCCCCN3C=CN=C3

InChI

InChI=1S/C18H19N5O3/c24-14-3-4-16-15(11-14)18(26)23(13-21-16)9-5-17(25)20-6-1-2-8-22-10-7-19-12-22/h3-5,7,9-13,24H,1-2,6,8H2,(H,20,25)/b9-5+