[4-[(3-bromanyl-4-methyl-phenyl)amino]phthalazin-1-yl]-pyridin-4-yl-methanone

Systemtic Name: [4-[(3-bromanyl-4-methyl-phenyl)amino]phthalazin-1-yl]-pyridin-4-yl-methanone Openeye Name: [4-(3-bromo-4-methyl-anilino)phthalazin-1-yl]-(4-pyridyl)methanone CAS Name: [4-(3-bromo-4-methylanilino)-1-phthalazinyl]-pyridin-4-ylmethanone IUPAC Name: [4-(3-bromo-4-methylanilino)phthalazin-1-yl]-pyridin-4-ylmethanone Traditional Name: [4-(3-bromo-4-methyl-anilino)phthalazin-1-yl]-(4-pyridyl)methanone Formula: C21H15BrN4O MolecularWeight: 419.274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C(=O)C4=CC=NC=C4)Br

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C(=O)C4=CC=NC=C4)Br

InChI

InChI=1S/C21H15BrN4O/c1-13-6-7-15(12-18(13)22)24-21-17-5-3-2-4-16(17)19(25-26-21)20(27)14-8-10-23-11-9-14/h2-12H,1H3,(H,24,26)