N-[4-[(3-bromophenyl)amino]quinazolin-6-yl]oxirane-2-carboxamide

Systemtic Name: N-[4-[(3-bromophenyl)amino]quinazolin-6-yl]oxirane-2-carboxamide Openeye Name: N-[4-(3-bromoanilino)quinazolin-6-yl]oxirane-2-carboxamide CAS Name: N-[4-(3-bromoanilino)-6-quinazolinyl]-2-oxiranecarboxamide IUPAC Name: N-[4-(3-bromoanilino)quinazolin-6-yl]oxirane-2-carboxamide Traditional Name: N-[4-(3-bromoanilino)quinazolin-6-yl]oxirane-2-carboxamide Formula: C17H13BrN4O2 MolecularWeight: 385.21472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)C(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC(=CC=C4)Br

Isomeric SMILES

C1C(O1)C(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC(=CC=C4)Br

InChI

InChI=1S/C17H13BrN4O2/c18-10-2-1-3-11(6-10)21-16-13-7-12(22-17(23)15-8-24-15)4-5-14(13)19-9-20-16/h1-7,9,15H,8H2,(H,22,23)(H,19,20,21)