2-methyl-2-(1-methylimidazol-2-yl)sulfanyl-propanoic acid

Systemtic Name: 2-methyl-2-(1-methylimidazol-2-yl)sulfanyl-propanoic acid Openeye Name: 2-methyl-2-(1-methylimidazol-2-yl)sulfanyl-propanoic acid CAS Name: 2-methyl-2-[(1-methyl-2-imidazolyl)thio]propanoic acid IUPAC Name: 2-methyl-2-(1-methylimidazol-2-yl)sulfanylpropanoic acid Traditional Name: 2-methyl-2-[(1-methylimidazol-2-yl)thio]propionic acid Formula: C8H12N2O2S MolecularWeight: 200.25808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)SC1=NC=CN1C

Isomeric SMILES

CC(C)(C(=O)O)SC1=NC=CN1C

InChI

InChI=1S/C8H12N2O2S/c1-8(2,6(11)12)13-7-9-4-5-10(7)3/h4-5H,1-3H3,(H,11,12)