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

Systemtic Name: (4E)-4-(5-chloranylbenzimidazol-2-ylidene)-6-[2-[[(1R)-1-phenylethyl]amino]pyrimidin-4-yl]-1,2-dihydropyridazin-3-one Openeye Name: (4E)-4-(5-chlorobenzimidazol-2-ylidene)-6-[2-[[(1R)-1-phenylethyl]amino]pyrimidin-4-yl]-1,2-dihydropyridazin-3-one CAS Name: (4E)-4-(5-chloro-2-benzimidazolylidene)-6-[2-[[(1R)-1-phenylethyl]amino]-4-pyrimidinyl]-1,2-dihydropyridazin-3-one IUPAC Name: (4E)-4-(5-chlorobenzimidazol-2-ylidene)-6-[2-[[(1R)-1-phenylethyl]amino]pyrimidin-4-yl]-1,2-dihydropyridazin-3-one Traditional Name: (4E)-4-(5-chlorobenzimidazol-2-ylidene)-6-[2-[[(1R)-1-phenylethyl]amino]pyrimidin-4-yl]-1,2-dihydropyridazin-3-one Formula: C23H18ClN7O MolecularWeight: 443.88832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)C3=CC(=C4N=C5C=CC(=CC5=N4)Cl)C(=O)NN3

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC2=NC=CC(=N2)C3=C/C(=C\4/N=C5C=CC(=CC5=N4)Cl)/C(=O)NN3

InChI

InChI=1S/C23H18ClN7O/c1-13(14-5-3-2-4-6-14)26-23-25-10-9-18(29-23)20-12-16(22(32)31-30-20)21-27-17-8-7-15(24)11-19(17)28-21/h2-13,30H,1H3,(H,31,32)(H,25,26,29)/b21-16+/t13-/m1/s1