N-[3-[[4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)butanoylamino]methyl]phenyl]furan-2-carboxamide

Systemtic Name: N-[3-[[4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)butanoylamino]methyl]phenyl]furan-2-carboxamide Openeye Name: N-[3-[[4-(2-methyl-4-oxo-quinazolin-3-yl)butanoylamino]methyl]phenyl]furan-2-carboxamide CAS Name: N-[3-[[[4-(2-methyl-4-oxo-3-quinazolinyl)-1-oxobutyl]amino]methyl]phenyl]-2-furancarboxamide IUPAC Name: N-[3-[[4-(2-methyl-4-oxoquinazolin-3-yl)butanoylamino]methyl]phenyl]furan-2-carboxamide Traditional Name: N-[3-[[4-(4-keto-2-methyl-quinazolin-3-yl)butanoylamino]methyl]phenyl]-2-furamide Formula: C25H24N4O4 MolecularWeight: 444.48246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCCC(=O)NCC3=CC(=CC=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCCC(=O)NCC3=CC(=CC=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C25H24N4O4/c1-17-27-21-10-3-2-9-20(21)25(32)29(17)13-5-12-23(30)26-16-18-7-4-8-19(15-18)28-24(31)22-11-6-14-33-22/h2-4,6-11,14-15H,5,12-13,16H2,1H3,(H,26,30)(H,28,31)