1-phenacyl-6-sulfanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-phenacyl-6-sulfanylidene-pyridine-3-carboxylic acid Openeye Name: 1-phenacyl-6-thioxo-pyridine-3-carboxylic acid CAS Name: 1-phenacyl-6-sulfanylidene-3-pyridinecarboxylic acid IUPAC Name: 1-phenacyl-6-sulfanylidenepyridine-3-carboxylic acid Traditional Name: 1-phenacyl-6-thioxo-nicotinic acid Formula: C14H11NO3S MolecularWeight: 273.30704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CN2C=C(C=CC2=S)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CN2C=C(C=CC2=S)C(=O)O

InChI

InChI=1S/C14H11NO3S/c16-12(10-4-2-1-3-5-10)9-15-8-11(14(17)18)6-7-13(15)19/h1-8H,9H2,(H,17,18)