2-[[4-azanyl-5-(2-methylcyclopropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[4-azanyl-5-(2-methylcyclopropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[4-amino-5-(2-methylcyclopropyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[4-amino-5-(2-methylcyclopropyl)-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[4-amino-5-(2-methylcyclopropyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-amino-5-(2-methylcyclopropyl)-1,2,4-triazol-3-yl]thio]acetic acid Formula: C8H12N4O2S MolecularWeight: 228.27148

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C2=NN=C(N2N)SCC(=O)O

Isomeric SMILES

CC1CC1C2=NN=C(N2N)SCC(=O)O

InChI

InChI=1S/C8H12N4O2S/c1-4-2-5(4)7-10-11-8(12(7)9)15-3-6(13)14/h4-5H,2-3,9H2,1H3,(H,13,14)