2-[(6-azanylpyridin-3-yl)methyl]-2-(sulfanylmethyl)butanoic acid

Systemtic Name: 2-[(6-azanylpyridin-3-yl)methyl]-2-(sulfanylmethyl)butanoic acid Openeye Name: 2-[(6-amino-3-pyridyl)methyl]-2-(sulfanylmethyl)butanoic acid CAS Name: 2-[(6-amino-3-pyridinyl)methyl]-2-(mercaptomethyl)butanoic acid IUPAC Name: 2-[(6-aminopyridin-3-yl)methyl]-2-(sulfanylmethyl)butanoic acid Traditional Name: 2-[(6-amino-3-pyridyl)methyl]-2-(mercaptomethyl)butyric acid Formula: C11H16N2O2S MolecularWeight: 240.32194

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CN=C(C=C1)N)(CS)C(=O)O

Isomeric SMILES

CCC(CC1=CN=C(C=C1)N)(CS)C(=O)O

InChI

InChI=1S/C11H16N2O2S/c1-2-11(7-16,10(14)15)5-8-3-4-9(12)13-6-8/h3-4,6,16H,2,5,7H2,1H3,(H2,12,13)(H,14,15)