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

Systemtic Name: N-[3-[[4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)butanoylamino]methyl]phenyl]cyclobutanecarboxamide Openeye Name: N-[3-[[4-(2-methyl-4-oxo-quinazolin-3-yl)butanoylamino]methyl]phenyl]cyclobutanecarboxamide CAS Name: N-[3-[[[4-(2-methyl-4-oxo-3-quinazolinyl)-1-oxobutyl]amino]methyl]phenyl]cyclobutanecarboxamide IUPAC Name: N-[3-[[4-(2-methyl-4-oxoquinazolin-3-yl)butanoylamino]methyl]phenyl]cyclobutanecarboxamide Traditional Name: N-[3-[[4-(4-keto-2-methyl-quinazolin-3-yl)butanoylamino]methyl]phenyl]cyclobutanecarboxamide Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCCC(=O)NCC3=CC(=CC=C3)NC(=O)C4CCC4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCCC(=O)NCC3=CC(=CC=C3)NC(=O)C4CCC4

InChI

InChI=1S/C25H28N4O3/c1-17-27-22-12-3-2-11-21(22)25(32)29(17)14-6-13-23(30)26-16-18-7-4-10-20(15-18)28-24(31)19-8-5-9-19/h2-4,7,10-12,15,19H,5-6,8-9,13-14,16H2,1H3,(H,26,30)(H,28,31)