(E)-N-[4-[(3-bromophenyl)amino]quinazolin-6-yl]-4-(methylamino)but-2-enamide

Systemtic Name: (E)-N-[4-[(3-bromophenyl)amino]quinazolin-6-yl]-4-(methylamino)but-2-enamide Openeye Name: (E)-N-[4-(3-bromoanilino)quinazolin-6-yl]-4-(methylamino)but-2-enamide CAS Name: (E)-N-[4-(3-bromoanilino)-6-quinazolinyl]-4-(methylamino)-2-butenamide IUPAC Name: (E)-N-[4-(3-bromoanilino)quinazolin-6-yl]-4-(methylamino)but-2-enamide Traditional Name: (E)-N-[4-(3-bromoanilino)quinazolin-6-yl]-4-(methylamino)but-2-enamide Formula: C19H18BrN5O MolecularWeight: 412.28312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNCC=CC(=O)NC1=CC2=C(C=C1)N=CN=C2NC3=CC(=CC=C3)Br

Isomeric SMILES

CNC/C=C/C(=O)NC1=CC2=C(C=C1)N=CN=C2NC3=CC(=CC=C3)Br

InChI

InChI=1S/C19H18BrN5O/c1-21-9-3-6-18(26)24-15-7-8-17-16(11-15)19(23-12-22-17)25-14-5-2-4-13(20)10-14/h2-8,10-12,21H,9H2,1H3,(H,24,26)(H,22,23,25)/b6-3+