2-[(6-azanylpyridin-3-yl)methyl]-2-methyl-3-sulfanyl-propanoic acid

Systemtic Name: 2-[(6-azanylpyridin-3-yl)methyl]-2-methyl-3-sulfanyl-propanoic acid Openeye Name: 2-[(6-amino-3-pyridyl)methyl]-2-methyl-3-sulfanyl-propanoic acid CAS Name: 2-[(6-amino-3-pyridinyl)methyl]-3-mercapto-2-methylpropanoic acid IUPAC Name: 2-[(6-aminopyridin-3-yl)methyl]-2-methyl-3-sulfanylpropanoic acid Traditional Name: 2-[(6-amino-3-pyridyl)methyl]-3-mercapto-2-methyl-propionic acid Formula: C10H14N2O2S MolecularWeight: 226.29536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14N2O2S/c1-10(6-15,9(13)14)4-7-2-3-8(11)12-5-7/h2-3,5,15H,4,6H2,1H3,(H2,11,12)(H,13,14)