8-phenacylsulfanylquinoline-5-carboxylic acid

Systemtic Name: 8-phenacylsulfanylquinoline-5-carboxylic acid Openeye Name: 8-phenacylsulfanylquinoline-5-carboxylic acid CAS Name: 8-(phenacylthio)-5-quinolinecarboxylic acid IUPAC Name: 8-phenacylsulfanylquinoline-5-carboxylic acid Traditional Name: 8-(phenacylthio)quinoline-5-carboxylic acid Formula: C18H13NO3S MolecularWeight: 323.36572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=C3C(=C(C=C2)C(=O)O)C=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=C3C(=C(C=C2)C(=O)O)C=CC=N3

InChI

InChI=1S/C18H13NO3S/c20-15(12-5-2-1-3-6-12)11-23-16-9-8-14(18(21)22)13-7-4-10-19-17(13)16/h1-10H,11H2,(H,21,22)