4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]butanamide

Systemtic Name: 4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]butanamide Openeye Name: 4-(8-methyl-4-oxo-quinazolin-3-yl)-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]butanamide CAS Name: 4-(8-methyl-4-oxo-3-quinazolinyl)-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]butanamide IUPAC Name: 4-(8-methyl-4-oxoquinazolin-3-yl)-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]butanamide Traditional Name: 4-(4-keto-8-methyl-quinazolin-3-yl)-N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]butyramide Formula: C23H20F3N3O2 MolecularWeight: 427.41901

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)NCC#CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)NCC#CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C23H20F3N3O2/c1-16-6-2-10-19-21(16)28-15-29(22(19)31)13-5-11-20(30)27-12-4-8-17-7-3-9-18(14-17)23(24,25)26/h2-3,6-7,9-10,14-15H,5,11-13H2,1H3,(H,27,30)