2-azanyl-3-[(5-nitro-2-sulfanylidene-1H-pyridin-3-yl)sulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[(5-nitro-2-sulfanylidene-1H-pyridin-3-yl)sulfanyl]propanoic acid Openeye Name: 2-amino-3-[(5-nitro-2-thioxo-1H-pyridin-3-yl)sulfanyl]propanoic acid CAS Name: 2-amino-3-[(5-nitro-2-sulfanylidene-1H-pyridin-3-yl)thio]propanoic acid IUPAC Name: 2-amino-3-[(5-nitro-2-sulfanylidene-1H-pyridin-3-yl)sulfanyl]propanoic acid Traditional Name: 2-amino-3-[(5-nitro-2-thioxo-1H-pyridin-3-yl)thio]propionic acid Formula: C8H9N3O4S2 MolecularWeight: 275.30476

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=S)NC=C1[N+](=O)[O-])SCC(C(=O)O)N

Isomeric SMILES

C1=C(C(=S)NC=C1[N+](=O)[O-])SCC(C(=O)O)N

InChI

InChI=1S/C8H9N3O4S2/c9-5(8(12)13)3-17-6-1-4(11(14)15)2-10-7(6)16/h1-2,5H,3,9H2,(H,10,16)(H,12,13)