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

Systemtic Name: tert-butyl 2-(4-azanyl-5-sulfanylidene-1,2,4-triazol-1-yl)ethanoate Openeye Name: tert-butyl 2-(4-amino-5-thioxo-1,2,4-triazol-1-yl)acetate CAS Name: 2-(4-amino-5-sulfanylidene-1,2,4-triazol-1-yl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-amino-5-sulfanylidene-1,2,4-triazol-1-yl)acetate Traditional Name: 2-(4-amino-5-thioxo-1,2,4-triazol-1-yl)acetic acid tert-butyl ester Formula: C8H14N4O2S MolecularWeight: 230.28736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C(=S)N(C=N1)N

Isomeric SMILES

CC(C)(C)OC(=O)CN1C(=S)N(C=N1)N

InChI

InChI=1S/C8H14N4O2S/c1-8(2,3)14-6(13)4-12-7(15)11(9)5-10-12/h5H,4,9H2,1-3H3