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2-(6-oxidanylidene-2-sulfanylidene-3,7-dihydropurin-8-yl)ethanenitrile

2-(6-oxidanylidene-2-sulfanylidene-3,7-dihydropurin-8-yl)ethanenitrile

Systemtic Name:2-(6-oxidanylidene-2-sulfanylidene-3,7-dihydropurin-8-yl)ethanenitrile
Openeye Name:2-(6-oxo-2-thioxo-3,7-dihydropurin-8-yl)acetonitrile
CAS Name:2-(6-oxo-2-sulfanylidene-3,7-dihydropurin-8-yl)acetonitrile
IUPAC Name:2-(6-oxo-2-sulfanylidene-3,7-dihydropurin-8-yl)acetonitrile
Traditional Name:2-(6-keto-2-thioxo-3,7-dihydropurin-8-yl)acetonitrile
Formula: C7H5N5OS
MolecularWeight: 207.2125
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Descriptors Computed from Structure

Canonical SMILES:

C(C#N)C1=NC2=C(N1)C(=O)NC(=S)N2


Isomeric SMILES

C(C#N)C1=NC2=C(N1)C(=O)NC(=S)N2


InChI

InChI=1S/C7H5N5OS/c8-2-1-3-9-4-5(10-3)11-7(14)12-6(4)13/h1H2,(H3,9,10,11,12,13,14)


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