2-[(4-phenylsulfanylphenyl)amino]pyridine-3-carboxylic acid

Systemtic Name: 2-[(4-phenylsulfanylphenyl)amino]pyridine-3-carboxylic acid Openeye Name: 2-(4-phenylsulfanylanilino)pyridine-3-carboxylic acid CAS Name: 2-[4-(phenylthio)anilino]-3-pyridinecarboxylic acid IUPAC Name: 2-(4-phenylsulfanylanilino)pyridine-3-carboxylic acid Traditional Name: 2-[4-(phenylthio)anilino]nicotinic acid Formula: C18H14N2O2S MolecularWeight: 322.38096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=C(C=C2)NC3=C(C=CC=N3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=C(C=C2)NC3=C(C=CC=N3)C(=O)O

InChI

InChI=1S/C18H14N2O2S/c21-18(22)16-7-4-12-19-17(16)20-13-8-10-15(11-9-13)23-14-5-2-1-3-6-14/h1-12H,(H,19,20)(H,21,22)