2-(4-carboxypyridin-2-yl)-3,5-dithiocyanato-pyridine-4-carboxylic acid

Systemtic Name: 2-(4-carboxypyridin-2-yl)-3,5-dithiocyanato-pyridine-4-carboxylic acid Openeye Name: 2-(4-carboxy-2-pyridyl)-3,5-dithiocyanato-pyridine-4-carboxylic acid CAS Name: 2-(4-carboxy-2-pyridinyl)-3,5-dithiocyanato-4-pyridinecarboxylic acid IUPAC Name: 2-(4-carboxypyridin-2-yl)-3,5-dithiocyanatopyridine-4-carboxylic acid Traditional Name: 2-(4-carboxy-2-pyridyl)-3,5-dithiocyanato-isonicotinic acid Formula: C14H6N4O4S2 MolecularWeight: 358.35184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C=C1C(=O)O)C2=NC=C(C(=C2SC#N)C(=O)O)SC#N

Isomeric SMILES

C1=CN=C(C=C1C(=O)O)C2=NC=C(C(=C2SC#N)C(=O)O)SC#N

InChI

InChI=1S/C14H6N4O4S2/c15-5-23-9-4-18-11(12(24-6-16)10(9)14(21)22)8-3-7(13(19)20)1-2-17-8/h1-4H,(H,19,20)(H,21,22)