3-(1H-pyrrol-2-ylcarbothioylamino)pyridine-2-carboxylic acid

Systemtic Name: 3-(1H-pyrrol-2-ylcarbothioylamino)pyridine-2-carboxylic acid Openeye Name: 3-(1H-pyrrole-2-carbothioylamino)pyridine-2-carboxylic acid CAS Name: 3-[[1H-pyrrol-2-yl(sulfanylidene)methyl]amino]-2-pyridinecarboxylic acid IUPAC Name: 3-(1H-pyrrole-2-carbothioylamino)pyridine-2-carboxylic acid Traditional Name: 3-(1H-pyrrole-2-carbothioylamino)picolinic acid Formula: C11H9N3O2S MolecularWeight: 247.27306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)C(=O)O)NC(=S)C2=CC=CN2

Isomeric SMILES

C1=CC(=C(N=C1)C(=O)O)NC(=S)C2=CC=CN2

InChI

InChI=1S/C11H9N3O2S/c15-11(16)9-7(3-1-6-13-9)14-10(17)8-4-2-5-12-8/h1-6,12H,(H,14,17)(H,15,16)