tert-butyl 2-(4-acetamido-5-sulfanylidene-1,2,4-triazol-1-yl)ethanoate

Systemtic Name: tert-butyl 2-(4-acetamido-5-sulfanylidene-1,2,4-triazol-1-yl)ethanoate Openeye Name: tert-butyl 2-(4-acetamido-5-thioxo-1,2,4-triazol-1-yl)acetate CAS Name: 2-(4-acetamido-5-sulfanylidene-1,2,4-triazol-1-yl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-acetamido-5-sulfanylidene-1,2,4-triazol-1-yl)acetate Traditional Name: 2-(4-acetamido-5-thioxo-1,2,4-triazol-1-yl)acetic acid tert-butyl ester Formula: C10H16N4O3S MolecularWeight: 272.32404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NN1C=NN(C1=S)CC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)NN1C=NN(C1=S)CC(=O)OC(C)(C)C

InChI

InChI=1S/C10H16N4O3S/c1-7(15)12-14-6-11-13(9(14)18)5-8(16)17-10(2,3)4/h6H,5H2,1-4H3,(H,12,15)