2-[(2E)-2-phenyl-2-(pyridin-4-ylcarbonylhydrazinylidene)ethyl]sulfanylethanoic acid

Systemtic Name: 2-[(2E)-2-phenyl-2-(pyridin-4-ylcarbonylhydrazinylidene)ethyl]sulfanylethanoic acid Openeye Name: 2-[(2E)-2-phenyl-2-(pyridine-4-carbonylhydrazono)ethyl]sulfanylacetic acid CAS Name: 2-[[(2E)-2-[[oxo(pyridin-4-yl)methyl]hydrazinylidene]-2-phenylethyl]thio]acetic acid IUPAC Name: 2-[(2E)-2-phenyl-2-(pyridine-4-carbonylhydrazinylidene)ethyl]sulfanylacetic acid Traditional Name: 2-[[(2E)-2-(isonicotinoylhydrazono)-2-phenyl-ethyl]thio]acetic acid Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)/C(=N\NC(=O)C2=CC=NC=C2)/CSCC(=O)O

InChI

InChI=1S/C16H15N3O3S/c20-15(21)11-23-10-14(12-4-2-1-3-5-12)18-19-16(22)13-6-8-17-9-7-13/h1-9H,10-11H2,(H,19,22)(H,20,21)/b18-14-