methyl 2-(6-sulfanylidene-1,2,4,5-tetrazinan-3-yl)ethanoate

Systemtic Name: methyl 2-(6-sulfanylidene-1,2,4,5-tetrazinan-3-yl)ethanoate Openeye Name: methyl 2-(6-thioxo-1,2,4,5-tetrazinan-3-yl)acetate CAS Name: 2-(6-sulfanylidene-1,2,4,5-tetrazinan-3-yl)acetic acid methyl ester IUPAC Name: methyl 2-(6-sulfanylidene-1,2,4,5-tetrazinan-3-yl)acetate Traditional Name: 2-(6-thioxo-1,2,4,5-tetrazinan-3-yl)acetic acid methyl ester Formula: C5H10N4O2S MolecularWeight: 190.2235

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1NNC(=S)NN1

Isomeric SMILES

COC(=O)CC1NNC(=S)NN1

InChI

InChI=1S/C5H10N4O2S/c1-11-4(10)2-3-6-8-5(12)9-7-3/h3,6-7H,2H2,1H3,(H2,8,9,12)