4-[2-oxidanylidene-2-(2-pyridin-2-ylhydrazinyl)ethyl]sulfanylbenzoic acid

Systemtic Name: 4-[2-oxidanylidene-2-(2-pyridin-2-ylhydrazinyl)ethyl]sulfanylbenzoic acid Openeye Name: 4-[2-oxo-2-[2-(2-pyridyl)hydrazino]ethyl]sulfanylbenzoic acid CAS Name: 4-[[2-oxo-2-(2-pyridinylhydrazo)ethyl]thio]benzoic acid IUPAC Name: 4-[2-oxo-2-(2-pyridin-2-ylhydrazinyl)ethyl]sulfanylbenzoic acid Traditional Name: 4-[[2-keto-2-[N'-(2-pyridyl)hydrazino]ethyl]thio]benzoic acid Formula: C14H13N3O3S MolecularWeight: 303.33632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NNC(=O)CSC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC=NC(=C1)NNC(=O)CSC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H13N3O3S/c18-13(17-16-12-3-1-2-8-15-12)9-21-11-6-4-10(5-7-11)14(19)20/h1-8H,9H2,(H,15,16)(H,17,18)(H,19,20)