2-[6-methyl-5-oxidanyl-4-(sulfanylmethyl)pyridin-3-yl]ethanoic acid

Systemtic Name: 2-[6-methyl-5-oxidanyl-4-(sulfanylmethyl)pyridin-3-yl]ethanoic acid Openeye Name: 2-[5-hydroxy-6-methyl-4-(sulfanylmethyl)-3-pyridyl]acetic acid CAS Name: 2-[5-hydroxy-4-(mercaptomethyl)-6-methyl-3-pyridinyl]acetic acid IUPAC Name: 2-[5-hydroxy-6-methyl-4-(sulfanylmethyl)pyridin-3-yl]acetic acid Traditional Name: 2-[5-hydroxy-4-(mercaptomethyl)-6-methyl-3-pyridyl]acetic acid Formula: C9H11NO3S MolecularWeight: 213.25354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CS)CC(=O)O

Isomeric SMILES

CC1=NC=C(C(=C1O)CS)CC(=O)O

InChI

InChI=1S/C9H11NO3S/c1-5-9(13)7(4-14)6(3-10-5)2-8(11)12/h3,13-14H,2,4H2,1H3,(H,11,12)