5-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]thiophene-2-carboxylic acid Openeye Name: 5-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]thiophene-2-carboxylic acid CAS Name: 5-[[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]thiophene-2-carboxylic acid Traditional Name: 5-[[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-2-thenoic acid Formula: C9H10N4O2S2 MolecularWeight: 270.3313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N)SCC2=CC=C(S2)C(=O)O

Isomeric SMILES

CC1=NN=C(N1N)SCC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C9H10N4O2S2/c1-5-11-12-9(13(5)10)16-4-6-2-3-7(17-6)8(14)15/h2-3H,4,10H2,1H3,(H,14,15)