5-[[4-[(3-bromanyl-4-ethyl-phenyl)amino]phthalazin-1-yl]methyl]-1H-pyridin-2-one

Systemtic Name: 5-[[4-[(3-bromanyl-4-ethyl-phenyl)amino]phthalazin-1-yl]methyl]-1H-pyridin-2-one Openeye Name: 5-[[4-(3-bromo-4-ethyl-anilino)phthalazin-1-yl]methyl]-1H-pyridin-2-one CAS Name: 5-[[4-(3-bromo-4-ethylanilino)-1-phthalazinyl]methyl]-1H-pyridin-2-one IUPAC Name: 5-[[4-(3-bromo-4-ethylanilino)phthalazin-1-yl]methyl]-1H-pyridin-2-one Traditional Name: 5-[[4-(3-bromo-4-ethyl-anilino)phthalazin-1-yl]methyl]-2-pyridone Formula: C22H19BrN4O MolecularWeight: 435.31646

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NC2=NN=C(C3=CC=CC=C32)CC4=CNC(=O)C=C4)Br

Isomeric SMILES

CCC1=C(C=C(C=C1)NC2=NN=C(C3=CC=CC=C32)CC4=CNC(=O)C=C4)Br

InChI

InChI=1S/C22H19BrN4O/c1-2-15-8-9-16(12-19(15)23)25-22-18-6-4-3-5-17(18)20(26-27-22)11-14-7-10-21(28)24-13-14/h3-10,12-13H,2,11H2,1H3,(H,24,28)(H,25,27)