(E)-N-(4-imidazol-1-ylbutyl)-3-[4-oxidanylidene-6,8-di(propan-2-yl)quinazolin-3-yl]prop-2-enamide

Systemtic Name: (E)-N-(4-imidazol-1-ylbutyl)-3-[4-oxidanylidene-6,8-di(propan-2-yl)quinazolin-3-yl]prop-2-enamide Openeye Name: (E)-3-(6,8-diisopropyl-4-oxo-quinazolin-3-yl)-N-(4-imidazol-1-ylbutyl)prop-2-enamide CAS Name: (E)-N-[4-(1-imidazolyl)butyl]-3-[4-oxo-6,8-di(propan-2-yl)-3-quinazolinyl]-2-propenamide IUPAC Name: (E)-N-(4-imidazol-1-ylbutyl)-3-[4-oxo-6,8-di(propan-2-yl)quinazolin-3-yl]prop-2-enamide Traditional Name: (E)-3-(6,8-diisopropyl-4-keto-quinazolin-3-yl)-N-(4-imidazol-1-ylbutyl)acrylamide Formula: C24H31N5O2 MolecularWeight: 421.53524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C2C(=C1)C(=O)N(C=N2)C=CC(=O)NCCCCN3C=CN=C3)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C2C(=C1)C(=O)N(C=N2)/C=C/C(=O)NCCCCN3C=CN=C3)C(C)C

InChI

InChI=1S/C24H31N5O2/c1-17(2)19-13-20(18(3)4)23-21(14-19)24(31)29(16-27-23)11-7-22(30)26-8-5-6-10-28-12-9-25-15-28/h7,9,11-18H,5-6,8,10H2,1-4H3,(H,26,30)/b11-7+