2-(4-methylphenyl)sulfanylethyl 1H-indazole-3-carboxylate

Systemtic Name: 2-(4-methylphenyl)sulfanylethyl 1H-indazole-3-carboxylate Openeye Name: 2-(p-tolylsulfanyl)ethyl 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid 2-[(4-methylphenyl)thio]ethyl ester IUPAC Name: 2-(4-methylphenyl)sulfanylethyl 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid 2-(p-tolylthio)ethyl ester Formula: C17H16N2O2S MolecularWeight: 312.38614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCOC(=O)C2=NNC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)SCCOC(=O)C2=NNC3=CC=CC=C32

InChI

InChI=1S/C17H16N2O2S/c1-12-6-8-13(9-7-12)22-11-10-21-17(20)16-14-4-2-3-5-15(14)18-19-16/h2-9H,10-11H2,1H3,(H,18,19)