(E)-4-(2-methyl-6-oxidanylidene-morpholin-4-yl)-N-[4-[(3-methylphenyl)amino]quinazolin-6-yl]but-2-enamide

Systemtic Name: (E)-4-(2-methyl-6-oxidanylidene-morpholin-4-yl)-N-[4-[(3-methylphenyl)amino]quinazolin-6-yl]but-2-enamide Openeye Name: (E)-N-[4-(3-methylanilino)quinazolin-6-yl]-4-(2-methyl-6-oxo-morpholin-4-yl)but-2-enamide CAS Name: (E)-N-[4-(3-methylanilino)-6-quinazolinyl]-4-(2-methyl-6-oxo-4-morpholinyl)-2-butenamide IUPAC Name: (E)-N-[4-(3-methylanilino)quinazolin-6-yl]-4-(2-methyl-6-oxomorpholin-4-yl)but-2-enamide Traditional Name: (E)-4-(2-keto-6-methyl-morpholino)-N-[4-(m-toluidino)quinazolin-6-yl]but-2-enamide Formula: C24H25N5O3 MolecularWeight: 431.487

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(=O)O1)CC=CC(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC=CC(=C4)C

Isomeric SMILES

CC1CN(CC(=O)O1)C/C=C/C(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC=CC(=C4)C

InChI

InChI=1S/C24H25N5O3/c1-16-5-3-6-18(11-16)28-24-20-12-19(8-9-21(20)25-15-26-24)27-22(30)7-4-10-29-13-17(2)32-23(31)14-29/h3-9,11-12,15,17H,10,13-14H2,1-2H3,(H,27,30)(H,25,26,28)/b7-4+