(2R)-3-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: (2R)-3-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-propanenitrile Openeye Name: (2R)-3-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(1-methylbenzimidazol-2-yl)-3-oxo-propanenitrile CAS Name: (2R)-3-[4-(3,5-dimethyl-1-pyrazolyl)phenyl]-2-(1-methyl-2-benzimidazolyl)-3-oxopropanenitrile IUPAC Name: (2R)-3-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-2-(1-methylbenzimidazol-2-yl)-3-oxopropanenitrile Traditional Name: (2R)-3-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-3-keto-2-(1-methylbenzimidazol-2-yl)propionitrile Formula: C22H19N5O MolecularWeight: 369.41916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)C(C#N)C3=NC4=CC=CC=C4N3C)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)[C@H](C#N)C3=NC4=CC=CC=C4N3C)C

InChI

InChI=1S/C22H19N5O/c1-14-12-15(2)27(25-14)17-10-8-16(9-11-17)21(28)18(13-23)22-24-19-6-4-5-7-20(19)26(22)3/h4-12,18H,1-3H3/t18-/m0/s1