(2R)-2-(1H-benzimidazol-2-yl)-2-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)ethanenitrile

Systemtic Name: (2R)-2-(1H-benzimidazol-2-yl)-2-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)ethanenitrile Openeye Name: (2R)-2-(1H-benzimidazol-2-yl)-2-(5-chloro-6-oxo-1-phenyl-pyridazin-4-yl)acetonitrile CAS Name: (2R)-2-(1H-benzimidazol-2-yl)-2-(5-chloro-6-oxo-1-phenyl-4-pyridazinyl)acetonitrile IUPAC Name: (2R)-2-(1H-benzimidazol-2-yl)-2-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)acetonitrile Traditional Name: (2R)-2-(1H-benzimidazol-2-yl)-2-(5-chloro-6-keto-1-phenyl-pyridazin-4-yl)acetonitrile Formula: C19H12ClN5O MolecularWeight: 361.78448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=C(C=N2)C(C#N)C3=NC4=CC=CC=C4N3)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=C(C=N2)[C@H](C#N)C3=NC4=CC=CC=C4N3)Cl

InChI

InChI=1S/C19H12ClN5O/c20-17-14(11-22-25(19(17)26)12-6-2-1-3-7-12)13(10-21)18-23-15-8-4-5-9-16(15)24-18/h1-9,11,13H,(H,23,24)/t13-/m0/s1