(E)-2-(1H-benzimidazol-2-yl)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-enenitrile Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acrylonitrile Formula: C21H17N5 MolecularWeight: 339.39318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=C(C#N)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=C(\C#N)/C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H17N5/c1-14-18(15(2)26(25-14)17-8-4-3-5-9-17)12-16(13-22)21-23-19-10-6-7-11-20(19)24-21/h3-12H,1-2H3,(H,23,24)/b16-12+