3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[3-(trifluoromethyloxy)phenyl]propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[3-(trifluoromethyloxy)phenyl]propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-[3-(trifluoromethoxy)phenyl]propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[3-(trifluoromethoxy)phenyl]propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-[3-(trifluoromethoxy)phenyl]propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-[3-(trifluoromethoxy)phenyl]propionamide Formula: C18H13BrF3N3O3 MolecularWeight: 456.21333

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(F)(F)F)NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC(=C1)OC(F)(F)F)NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C18H13BrF3N3O3/c19-11-4-5-15-14(8-11)17(27)25(10-23-15)7-6-16(26)24-12-2-1-3-13(9-12)28-18(20,21)22/h1-5,8-10H,6-7H2,(H,24,26)