2-[(5-methyl-2-pyridin-2-yl-pyrazol-3-yl)amino]-5-methylsulfanyl-benzoic acid

Systemtic Name: 2-[(5-methyl-2-pyridin-2-yl-pyrazol-3-yl)amino]-5-methylsulfanyl-benzoic acid Openeye Name: 2-[[5-methyl-2-(2-pyridyl)pyrazol-3-yl]amino]-5-methylsulfanyl-benzoic acid CAS Name: 2-[[5-methyl-2-(2-pyridinyl)-3-pyrazolyl]amino]-5-(methylthio)benzoic acid IUPAC Name: 2-[(5-methyl-2-pyridin-2-ylpyrazol-3-yl)amino]-5-methylsulfanylbenzoic acid Traditional Name: 2-[[5-methyl-2-(2-pyridyl)pyrazol-3-yl]amino]-5-(methylthio)benzoic acid Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC2=C(C=C(C=C2)SC)C(=O)O)C3=CC=CC=N3

Isomeric SMILES

CC1=NN(C(=C1)NC2=C(C=C(C=C2)SC)C(=O)O)C3=CC=CC=N3

InChI

InChI=1S/C17H16N4O2S/c1-11-9-16(21(20-11)15-5-3-4-8-18-15)19-14-7-6-12(24-2)10-13(14)17(22)23/h3-10,19H,1-2H3,(H,22,23)