(4E)-4-(5-chloranylbenzimidazol-2-ylidene)-6-[2-(methylamino)pyrimidin-4-yl]-1,2-dihydropyridazin-3-one

Systemtic Name: (4E)-4-(5-chloranylbenzimidazol-2-ylidene)-6-[2-(methylamino)pyrimidin-4-yl]-1,2-dihydropyridazin-3-one Openeye Name: (4E)-4-(5-chlorobenzimidazol-2-ylidene)-6-[2-(methylamino)pyrimidin-4-yl]-1,2-dihydropyridazin-3-one CAS Name: (4E)-4-(5-chloro-2-benzimidazolylidene)-6-[2-(methylamino)-4-pyrimidinyl]-1,2-dihydropyridazin-3-one IUPAC Name: (4E)-4-(5-chlorobenzimidazol-2-ylidene)-6-[2-(methylamino)pyrimidin-4-yl]-1,2-dihydropyridazin-3-one Traditional Name: (4E)-4-(5-chlorobenzimidazol-2-ylidene)-6-[2-(methylamino)pyrimidin-4-yl]-1,2-dihydropyridazin-3-one Formula: C16H12ClN7O MolecularWeight: 353.76578

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=CC(=N1)C2=CC(=C3N=C4C=CC(=CC4=N3)Cl)C(=O)NN2

Isomeric SMILES

CNC1=NC=CC(=N1)C2=C/C(=C\3/N=C4C=CC(=CC4=N3)Cl)/C(=O)NN2

InChI

InChI=1S/C16H12ClN7O/c1-18-16-19-5-4-11(22-16)13-7-9(15(25)24-23-13)14-20-10-3-2-8(17)6-12(10)21-14/h2-7,23H,1H3,(H,24,25)(H,18,19,22)/b14-9+