methyl 2-(3-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanoate

Systemtic Name: methyl 2-(3-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanoate Openeye Name: methyl 2-(3-isopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetate CAS Name: 2-(3-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetic acid methyl ester IUPAC Name: methyl 2-(3-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetate Traditional Name: 2-(3-isopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetic acid methyl ester Formula: C8H13N3O2S MolecularWeight: 215.27272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NNC(=S)N1CC(=O)OC

Isomeric SMILES

CC(C)C1=NNC(=S)N1CC(=O)OC

InChI

InChI=1S/C8H13N3O2S/c1-5(2)7-9-10-8(14)11(7)4-6(12)13-3/h5H,4H2,1-3H3,(H,10,14)