2-[2-(1,3-thiazol-2-ylmethylsulfanyl)ethylamino]pyridine-3-carboxylic acid

Systemtic Name: 2-[2-(1,3-thiazol-2-ylmethylsulfanyl)ethylamino]pyridine-3-carboxylic acid Openeye Name: 2-[2-(thiazol-2-ylmethylsulfanyl)ethylamino]pyridine-3-carboxylic acid CAS Name: 2-[2-(2-thiazolylmethylthio)ethylamino]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-(1,3-thiazol-2-ylmethylsulfanyl)ethylamino]pyridine-3-carboxylic acid Traditional Name: 2-[2-(thiazol-2-ylmethylthio)ethylamino]nicotinic acid Formula: C12H13N3O2S2 MolecularWeight: 295.38052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)NCCSCC2=NC=CS2)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)NCCSCC2=NC=CS2)C(=O)O

InChI

InChI=1S/C12H13N3O2S2/c16-12(17)9-2-1-3-14-11(9)15-4-6-18-8-10-13-5-7-19-10/h1-3,5,7H,4,6,8H2,(H,14,15)(H,16,17)