3-(4-oxidanylidene-6-sulfanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)propanenitrile

Systemtic Name: 3-(4-oxidanylidene-6-sulfanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)propanenitrile Openeye Name: 3-(4-oxo-6-thioxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)propanenitrile CAS Name: 3-(4-oxo-6-sulfanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)propanenitrile IUPAC Name: 3-(4-oxo-6-sulfanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)propanenitrile Traditional Name: 3-(4-keto-6-thioxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)propionitrile Formula: C8H7N5OS MolecularWeight: 221.23908

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=O)NC(=S)N=C2N(N1)CCC#N

Isomeric SMILES

C1=C2C(=O)NC(=S)N=C2N(N1)CCC#N

InChI

InChI=1S/C8H7N5OS/c9-2-1-3-13-6-5(4-10-13)7(14)12-8(15)11-6/h4,10H,1,3H2,(H,12,14,15)