N-[2-[(3-bromophenyl)amino]quinazolin-7-yl]-N-(3-morpholin-4-ylpropyl)prop-2-enamide

Systemtic Name: N-[2-[(3-bromophenyl)amino]quinazolin-7-yl]-N-(3-morpholin-4-ylpropyl)prop-2-enamide Openeye Name: N-[2-(3-bromoanilino)quinazolin-7-yl]-N-(3-morpholinopropyl)prop-2-enamide CAS Name: N-[2-(3-bromoanilino)-7-quinazolinyl]-N-[3-(4-morpholinyl)propyl]-2-propenamide IUPAC Name: N-[2-(3-bromoanilino)quinazolin-7-yl]-N-(3-morpholin-4-ylpropyl)prop-2-enamide Traditional Name: N-[2-(3-bromoanilino)quinazolin-7-yl]-N-(3-morpholinopropyl)acrylamide Formula: C24H26BrN5O2 MolecularWeight: 496.39954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)N(CCCN1CCOCC1)C2=CC3=NC(=NC=C3C=C2)NC4=CC(=CC=C4)Br

Isomeric SMILES

C=CC(=O)N(CCCN1CCOCC1)C2=CC3=NC(=NC=C3C=C2)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C24H26BrN5O2/c1-2-23(31)30(10-4-9-29-11-13-32-14-12-29)21-8-7-18-17-26-24(28-22(18)16-21)27-20-6-3-5-19(25)15-20/h2-3,5-8,15-17H,1,4,9-14H2,(H,26,27,28)