2-methyl-2-pyridin-4-ylsulfanyl-propanoic acid

Systemtic Name: 2-methyl-2-pyridin-4-ylsulfanyl-propanoic acid Openeye Name: 2-methyl-2-(4-pyridylsulfanyl)propanoic acid CAS Name: 2-methyl-2-(pyridin-4-ylthio)propanoic acid IUPAC Name: 2-methyl-2-pyridin-4-ylsulfanylpropanoic acid Traditional Name: 2-methyl-2-(4-pyridylthio)propionic acid Formula: C9H11NO2S MolecularWeight: 197.25414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)SC1=CC=NC=C1

Isomeric SMILES

CC(C)(C(=O)O)SC1=CC=NC=C1

InChI

InChI=1S/C9H11NO2S/c1-9(2,8(11)12)13-7-3-5-10-6-4-7/h3-6H,1-2H3,(H,11,12)