3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[(R)-cyclopropyl(phenyl)methyl]propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[(R)-cyclopropyl(phenyl)methyl]propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-[(R)-cyclopropyl(phenyl)methyl]propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[(R)-cyclopropyl(phenyl)methyl]propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-[(R)-cyclopropyl(phenyl)methyl]propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-[(R)-cyclopropyl(phenyl)methyl]propionamide Formula: C21H20BrN3O2 MolecularWeight: 426.3064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C2=CC=CC=C2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1CC1[C@H](C2=CC=CC=C2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C21H20BrN3O2/c22-16-8-9-18-17(12-16)21(27)25(13-23-18)11-10-19(26)24-20(15-6-7-15)14-4-2-1-3-5-14/h1-5,8-9,12-13,15,20H,6-7,10-11H2,(H,24,26)/t20-/m0/s1