4-[[4-[(3-bromophenyl)amino]phthalazin-1-yl]methyl]-N-methyl-pyridine-2-carboxamide

Systemtic Name: 4-[[4-[(3-bromophenyl)amino]phthalazin-1-yl]methyl]-N-methyl-pyridine-2-carboxamide Openeye Name: 4-[[4-(3-bromoanilino)phthalazin-1-yl]methyl]-N-methyl-pyridine-2-carboxamide CAS Name: 4-[[4-(3-bromoanilino)-1-phthalazinyl]methyl]-N-methyl-2-pyridinecarboxamide IUPAC Name: 4-[[4-(3-bromoanilino)phthalazin-1-yl]methyl]-N-methylpyridine-2-carboxamide Traditional Name: 4-[[4-(3-bromoanilino)phthalazin-1-yl]methyl]-N-methyl-picolinamide Formula: C22H18BrN5O MolecularWeight: 448.31522

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NC=CC(=C1)CC2=NN=C(C3=CC=CC=C32)NC4=CC(=CC=C4)Br

Isomeric SMILES

CNC(=O)C1=NC=CC(=C1)CC2=NN=C(C3=CC=CC=C32)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C22H18BrN5O/c1-24-22(29)20-12-14(9-10-25-20)11-19-17-7-2-3-8-18(17)21(28-27-19)26-16-6-4-5-15(23)13-16/h2-10,12-13H,11H2,1H3,(H,24,29)(H,26,28)