1-(4-methylsulfanylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic acid

Systemtic Name: 1-(4-methylsulfanylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic acid Openeye Name: 1-(4-methylsulfanylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic acid CAS Name: 1-[4-(methylthio)phenyl]-4,5,6,7-tetrahydroindazole-3-carboxylic acid IUPAC Name: 1-(4-methylsulfanylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic acid Traditional Name: 1-[4-(methylthio)phenyl]-4,5,6,7-tetrahydroindazole-3-carboxylic acid Formula: C15H16N2O2S MolecularWeight: 288.36474

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2C3=C(CCCC3)C(=N2)C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)N2C3=C(CCCC3)C(=N2)C(=O)O

InChI

InChI=1S/C15H16N2O2S/c1-20-11-8-6-10(7-9-11)17-13-5-3-2-4-12(13)14(16-17)15(18)19/h6-9H,2-5H2,1H3,(H,18,19)