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2-methyl-2-(5-sulfanylidene-1,2-dihydro-1,2,3-triazol-4-yl)propanoic acid

2-methyl-2-(5-sulfanylidene-1,2-dihydro-1,2,3-triazol-4-yl)propanoic acid

Systemtic Name:2-methyl-2-(5-sulfanylidene-1,2-dihydro-1,2,3-triazol-4-yl)propanoic acid
Openeye Name:2-methyl-2-(5-thioxo-1,2-dihydrotriazol-4-yl)propanoic acid
CAS Name:2-methyl-2-(5-sulfanylidene-1,2-dihydrotriazol-4-yl)propanoic acid
IUPAC Name:2-methyl-2-(5-sulfanylidene-1,2-dihydrotriazol-4-yl)propanoic acid
Traditional Name:2-methyl-2-(5-thioxo-1,2-dihydrotriazol-4-yl)propionic acid
Formula: C6H9N3O2S
MolecularWeight: 187.21956
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=NNNC1=S)C(=O)O


Isomeric SMILES

CC(C)(C1=NNNC1=S)C(=O)O


InChI

InChI=1S/C6H9N3O2S/c1-6(2,5(10)11)3-4(12)8-9-7-3/h1-2H3,(H,10,11)(H2,7,8,9,12)


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