methyl 4-azanyl-2-sulfanylidene-3-(1,2,4-triazol-4-yl)-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 4-azanyl-2-sulfanylidene-3-(1,2,4-triazol-4-yl)-1,3-thiazole-5-carboxylate Openeye Name: methyl 4-amino-2-thioxo-3-(1,2,4-triazol-4-yl)thiazole-5-carboxylate CAS Name: 4-amino-2-sulfanylidene-3-(1,2,4-triazol-4-yl)-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 4-amino-2-sulfanylidene-3-(1,2,4-triazol-4-yl)-1,3-thiazole-5-carboxylate Traditional Name: 4-amino-2-thioxo-3-(1,2,4-triazol-4-yl)-4-thiazoline-5-carboxylic acid methyl ester Formula: C7H7N5O2S2 MolecularWeight: 257.29278

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C(=S)S1)N2C=NN=C2)N

Isomeric SMILES

COC(=O)C1=C(N(C(=S)S1)N2C=NN=C2)N

InChI

InChI=1S/C7H7N5O2S2/c1-14-6(13)4-5(8)12(7(15)16-4)11-2-9-10-3-11/h2-3H,8H2,1H3