[2-tert-butyl-5-methyl-4-(4-methylphenyl)sulfanyl-pyrazol-3-yl] 2-(3-methylphenyl)ethanoate

Systemtic Name: [2-tert-butyl-5-methyl-4-(4-methylphenyl)sulfanyl-pyrazol-3-yl] 2-(3-methylphenyl)ethanoate Openeye Name: [2-tert-butyl-5-methyl-4-(p-tolylsulfanyl)pyrazol-3-yl] 2-(m-tolyl)acetate CAS Name: 2-(3-methylphenyl)acetic acid [2-tert-butyl-5-methyl-4-[(4-methylphenyl)thio]-3-pyrazolyl] ester IUPAC Name: [2-tert-butyl-5-methyl-4-(4-methylphenyl)sulfanylpyrazol-3-yl] 2-(3-methylphenyl)acetate Traditional Name: 2-(m-tolyl)acetic acid [2-tert-butyl-5-methyl-4-(p-tolylthio)pyrazol-3-yl] ester Formula: C24H28N2O2S MolecularWeight: 408.55632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(N(N=C2C)C(C)(C)C)OC(=O)CC3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(N(N=C2C)C(C)(C)C)OC(=O)CC3=CC=CC(=C3)C

InChI

InChI=1S/C24H28N2O2S/c1-16-10-12-20(13-11-16)29-22-18(3)25-26(24(4,5)6)23(22)28-21(27)15-19-9-7-8-17(2)14-19/h7-14H,15H2,1-6H3