(E)-2-(1H-benzimidazol-2-yl)-3-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)prop-2-enenitrile chloride

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)prop-2-enenitrile chloride Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)prop-2-enenitrile chloride CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-(1,3-dimethyl-2-oxo-5-benzimidazolyl)-2-propenenitrile chloride IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-(1,3-dimethyl-2-oxobenzimidazol-5-yl)prop-2-enenitrile chloride Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-(2-keto-1,3-dimethyl-benzimidazol-5-yl)acrylonitrile chloride Formula: C19H15ClN5O- MolecularWeight: 364.8083

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C=C(C#N)C3=NC4=CC=CC=C4N3)N(C1=O)C.[Cl-]

Isomeric SMILES

CN1C2=C(C=C(C=C2)/C=C(\C#N)/C3=NC4=CC=CC=C4N3)N(C1=O)C.[Cl-]

InChI

InChI=1S/C19H15N5O.ClH/c1-23-16-8-7-12(10-17(16)24(2)19(23)25)9-13(11-20)18-21-14-5-3-4-6-15(14)22-18;/h3-10H,1-2H3,(H,21,22);1H/p-1/b13-9+;