2-(pyridin-4-ylmethyl)-3-sulfanyl-butanoic acid

Systemtic Name: 2-(pyridin-4-ylmethyl)-3-sulfanyl-butanoic acid Openeye Name: 2-(4-pyridylmethyl)-3-sulfanyl-butanoic acid CAS Name: 3-mercapto-2-(pyridin-4-ylmethyl)butanoic acid IUPAC Name: 2-(pyridin-4-ylmethyl)-3-sulfanylbutanoic acid Traditional Name: 3-mercapto-2-(4-pyridylmethyl)butyric acid Formula: C10H13NO2S MolecularWeight: 211.28072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC=NC=C1)C(=O)O)S

Isomeric SMILES

CC(C(CC1=CC=NC=C1)C(=O)O)S

InChI

InChI=1S/C10H13NO2S/c1-7(14)9(10(12)13)6-8-2-4-11-5-3-8/h2-5,7,9,14H,6H2,1H3,(H,12,13)