N-(4-bromanyl-2-methyl-phenyl)-4-[3-(4-methylphenyl)-6-oxidanylidene-pyridazin-1-yl]butanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-4-[3-(4-methylphenyl)-6-oxidanylidene-pyridazin-1-yl]butanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-4-[6-oxo-3-(p-tolyl)pyridazin-1-yl]butanamide CAS Name: N-(4-bromo-2-methylphenyl)-4-[3-(4-methylphenyl)-6-oxo-1-pyridazinyl]butanamide IUPAC Name: N-(4-bromo-2-methylphenyl)-4-[3-(4-methylphenyl)-6-oxopyridazin-1-yl]butanamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-4-[6-keto-3-(p-tolyl)pyridazin-1-yl]butyramide Formula: C22H22BrN3O2 MolecularWeight: 440.33298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)NC3=C(C=C(C=C3)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)NC3=C(C=C(C=C3)Br)C

InChI

InChI=1S/C22H22BrN3O2/c1-15-5-7-17(8-6-15)20-11-12-22(28)26(25-20)13-3-4-21(27)24-19-10-9-18(23)14-16(19)2/h5-12,14H,3-4,13H2,1-2H3,(H,24,27)