2-(3-azanyl-1-sulfanyl-2-sulfanylidene-pyridin-4-yl)butanoic acid

Systemtic Name: 2-(3-azanyl-1-sulfanyl-2-sulfanylidene-pyridin-4-yl)butanoic acid Openeye Name: 2-(3-amino-1-sulfanyl-2-thioxo-4-pyridyl)butanoic acid CAS Name: 2-(3-amino-1-mercapto-2-sulfanylidene-4-pyridinyl)butanoic acid IUPAC Name: 2-(3-amino-1-sulfanyl-2-sulfanylidenepyridin-4-yl)butanoic acid Traditional Name: 2-(3-amino-1-mercapto-2-thioxo-4-pyridyl)butyric acid Formula: C9H12N2O2S2 MolecularWeight: 244.33378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C(=S)N(C=C1)S)N)C(=O)O

Isomeric SMILES

CCC(C1=C(C(=S)N(C=C1)S)N)C(=O)O

InChI

InChI=1S/C9H12N2O2S2/c1-2-5(9(12)13)6-3-4-11(15)8(14)7(6)10/h3-5,15H,2,10H2,1H3,(H,12,13)