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

Systemtic Name: 2-[(6-azanylpyridin-3-yl)methyl]-3-ethanoylsulfanyl-propanoic acid Openeye Name: 2-(acetylsulfanylmethyl)-3-(6-amino-3-pyridyl)propanoic acid CAS Name: 2-[(acetylthio)methyl]-3-(6-amino-3-pyridinyl)propanoic acid IUPAC Name: 2-(acetylsulfanylmethyl)-3-(6-aminopyridin-3-yl)propanoic acid Traditional Name: 2-[(acetylthio)methyl]-3-(6-amino-3-pyridyl)propionic acid Formula: C11H14N2O3S MolecularWeight: 254.30546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O3S/c1-7(14)17-6-9(11(15)16)4-8-2-3-10(12)13-5-8/h2-3,5,9H,4,6H2,1H3,(H2,12,13)(H,15,16)