2-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid

Systemtic Name: 2-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid Openeye Name: 2-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid CAS Name: 2-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)thio]propanoic acid IUPAC Name: 2-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoic acid Traditional Name: 2-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)thio]propionic acid Formula: C7H11N3O2S MolecularWeight: 201.24614

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=NN=CN1C)C(=O)O

Isomeric SMILES

CC(CSC1=NN=CN1C)C(=O)O

InChI

InChI=1S/C7H11N3O2S/c1-5(6(11)12)3-13-7-9-8-4-10(7)2/h4-5H,3H2,1-2H3,(H,11,12)