2-[2-(dimethylcarbamoyl)pyridin-4-yl]sulfanylethanoic acid

Systemtic Name: 2-[2-(dimethylcarbamoyl)pyridin-4-yl]sulfanylethanoic acid Openeye Name: 2-[[2-(dimethylcarbamoyl)-4-pyridyl]sulfanyl]acetic acid CAS Name: 2-[[2-[dimethylamino(oxo)methyl]-4-pyridinyl]thio]acetic acid IUPAC Name: 2-[2-(dimethylcarbamoyl)pyridin-4-yl]sulfanylacetic acid Traditional Name: 2-[[2-(dimethylcarbamoyl)-4-pyridyl]thio]acetic acid Formula: C10H12N2O3S MolecularWeight: 240.27888

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=NC=CC(=C1)SCC(=O)O

Isomeric SMILES

CN(C)C(=O)C1=NC=CC(=C1)SCC(=O)O

InChI

InChI=1S/C10H12N2O3S/c1-12(2)10(15)8-5-7(3-4-11-8)16-6-9(13)14/h3-5H,6H2,1-2H3,(H,13,14)