2-[4-[(3-bromophenyl)amino]-7-(3-morpholin-4-ylpropoxy)quinazolin-6-yl]prop-2-enamide

Systemtic Name: 2-[4-[(3-bromophenyl)amino]-7-(3-morpholin-4-ylpropoxy)quinazolin-6-yl]prop-2-enamide Openeye Name: 2-[4-(3-bromoanilino)-7-(3-morpholinopropoxy)quinazolin-6-yl]prop-2-enamide CAS Name: 2-[4-(3-bromoanilino)-7-[3-(4-morpholinyl)propoxy]-6-quinazolinyl]-2-propenamide IUPAC Name: 2-[4-(3-bromoanilino)-7-(3-morpholin-4-ylpropoxy)quinazolin-6-yl]prop-2-enamide Traditional Name: 2-[4-(3-bromoanilino)-7-(3-morpholinopropoxy)quinazolin-6-yl]acrylamide Formula: C24H26BrN5O3 MolecularWeight: 512.39894

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)Br)OCCCN4CCOCC4)C(=O)N

Isomeric SMILES

C=C(C1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)Br)OCCCN4CCOCC4)C(=O)N

InChI

InChI=1S/C24H26BrN5O3/c1-16(23(26)31)19-13-20-21(14-22(19)33-9-3-6-30-7-10-32-11-8-30)27-15-28-24(20)29-18-5-2-4-17(25)12-18/h2,4-5,12-15H,1,3,6-11H2,(H2,26,31)(H,27,28,29)