2-(1-azanyl-3-methyl-butan-2-yl)-3-(phenylmethyl)-7-(trifluoromethyl)quinazolin-4-one

Systemtic Name: 2-(1-azanyl-3-methyl-butan-2-yl)-3-(phenylmethyl)-7-(trifluoromethyl)quinazolin-4-one Openeye Name: 2-[1-(aminomethyl)-2-methyl-propyl]-3-benzyl-7-(trifluoromethyl)quinazolin-4-one CAS Name: 2-(1-amino-3-methylbutan-2-yl)-3-(phenylmethyl)-7-(trifluoromethyl)-4-quinazolinone IUPAC Name: 2-(1-amino-3-methylbutan-2-yl)-3-benzyl-7-(trifluoromethyl)quinazolin-4-one Traditional Name: 2-[1-(aminomethyl)-2-methyl-propyl]-3-benzyl-7-(trifluoromethyl)quinazolin-4-one Formula: C21H22F3N3O MolecularWeight: 389.41409

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CN)C1=NC2=C(C=CC(=C2)C(F)(F)F)C(=O)N1CC3=CC=CC=C3

Isomeric SMILES

CC(C)C(CN)C1=NC2=C(C=CC(=C2)C(F)(F)F)C(=O)N1CC3=CC=CC=C3

InChI

InChI=1S/C21H22F3N3O/c1-13(2)17(11-25)19-26-18-10-15(21(22,23)24)8-9-16(18)20(28)27(19)12-14-6-4-3-5-7-14/h3-10,13,17H,11-12,25H2,1-2H3