N-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanamide

Systemtic Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(6-bromo-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(6-bromo-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(6-bromo-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(6-bromo-4-keto-quinazolin-3-yl)propionamide Formula: C24H17BrN4O3 MolecularWeight: 489.32078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)NC(=O)CCN4C=NC5=C(C4=O)C=C(C=C5)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)NC(=O)CCN4C=NC5=C(C4=O)C=C(C=C5)Br

InChI

InChI=1S/C24H17BrN4O3/c25-16-7-10-19-18(13-16)24(31)29(14-26-19)12-11-22(30)27-17-8-5-15(6-9-17)23-28-20-3-1-2-4-21(20)32-23/h1-10,13-14H,11-12H2,(H,27,30)