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

Systemtic Name: 2-[[4-(1-cyclopropylethyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[4-(1-cyclopropylethyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[4-(1-cyclopropylethyl)-5-methyl-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[4-(1-cyclopropylethyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-(1-cyclopropylethyl)-5-methyl-1,2,4-triazol-3-yl]thio]acetic acid Formula: C10H15N3O2S MolecularWeight: 241.31

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C(C)C2CC2)SCC(=O)O

Isomeric SMILES

CC1=NN=C(N1C(C)C2CC2)SCC(=O)O

InChI

InChI=1S/C10H15N3O2S/c1-6(8-3-4-8)13-7(2)11-12-10(13)16-5-9(14)15/h6,8H,3-5H2,1-2H3,(H,14,15)