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[5-cyano-2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]methyl carbamimidothioate

[5-cyano-2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]methyl carbamimidothioate

Systemtic Name:[5-cyano-2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]methyl carbamimidothioate
Openeye Name:2-[(5-cyano-2,4-dioxo-1H-pyrimidin-6-yl)methyl]isothiourea
CAS Name:carbamimidothioic acid (5-cyano-2,4-dioxo-1H-pyrimidin-6-yl)methyl ester
IUPAC Name:(5-cyano-2,4-dioxo-1H-pyrimidin-6-yl)methyl carbamimidothioate
Traditional Name:2-[(5-cyano-2,4-diketo-1H-pyrimidin-6-yl)methyl]isothiourea
Formula: C7H7N5O2S
MolecularWeight: 225.22778
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Descriptors Computed from Structure

Canonical SMILES:

C(C1=C(C(=O)NC(=O)N1)C#N)SC(=N)N


Isomeric SMILES

C(C1=C(C(=O)NC(=O)N1)C#N)SC(=N)N


InChI

InChI=1S/C7H7N5O2S/c8-1-3-4(2-15-6(9)10)11-7(14)12-5(3)13/h2H2,(H3,9,10)(H2,11,12,13,14)


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