2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)-3-oxo-butanenitrile CAS Name: 2-(1,3-dimethyl-2-benzimidazolylidene)-4-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-3-oxobutanenitrile IUPAC Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-3-oxobutanenitrile Traditional Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-3-keto-4-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)butyronitrile Formula: C19H17N7O2 MolecularWeight: 375.38398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CN3C=NC4=C(C3=O)C=NN4C)C

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CN3C=NC4=C(C3=O)C=NN4C)C

InChI

InChI=1S/C19H17N7O2/c1-23-14-6-4-5-7-15(14)24(2)18(23)12(8-20)16(27)10-26-11-21-17-13(19(26)28)9-22-25(17)3/h4-7,9,11H,10H2,1-3H3