2-[[4-fluoranyl-3-(trifluoromethyl)phenyl]amino]-8-propan-2-yl-1H-quinazolin-7-one

Systemtic Name: 2-[[4-fluoranyl-3-(trifluoromethyl)phenyl]amino]-8-propan-2-yl-1H-quinazolin-7-one Openeye Name: 2-[4-fluoro-3-(trifluoromethyl)anilino]-8-isopropyl-1H-quinazolin-7-one CAS Name: 2-[4-fluoro-3-(trifluoromethyl)anilino]-8-propan-2-yl-1H-quinazolin-7-one IUPAC Name: 2-[4-fluoro-3-(trifluoromethyl)anilino]-8-propan-2-yl-1H-quinazolin-7-one Traditional Name: 2-[4-fluoro-3-(trifluoromethyl)anilino]-8-isopropyl-1H-quinazolin-7-one Formula: C18H15F4N3O MolecularWeight: 365.324813

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CN=C(N2)NC3=CC(=C(C=C3)F)C(F)(F)F)C=CC1=O

Isomeric SMILES

CC(C)C1=C2C(=CN=C(N2)NC3=CC(=C(C=C3)F)C(F)(F)F)C=CC1=O

InChI

InChI=1S/C18H15F4N3O/c1-9(2)15-14(26)6-3-10-8-23-17(25-16(10)15)24-11-4-5-13(19)12(7-11)18(20,21)22/h3-9H,1-2H3,(H2,23,24,25)