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

Systemtic Name: [5-methyl-4-(4-methylphenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-(3-methylphenyl)ethanoate Openeye Name: [5-methyl-2-phenyl-4-(p-tolylsulfanyl)pyrazol-3-yl] 2-(m-tolyl)acetate CAS Name: 2-(3-methylphenyl)acetic acid [5-methyl-4-[(4-methylphenyl)thio]-2-phenyl-3-pyrazolyl] ester IUPAC Name: [5-methyl-4-(4-methylphenyl)sulfanyl-2-phenylpyrazol-3-yl] 2-(3-methylphenyl)acetate Traditional Name: 2-(m-tolyl)acetic acid [5-methyl-2-phenyl-4-(p-tolylthio)pyrazol-3-yl] ester Formula: C26H24N2O2S MolecularWeight: 428.54596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(N(N=C2C)C3=CC=CC=C3)OC(=O)CC4=CC=CC(=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(N(N=C2C)C3=CC=CC=C3)OC(=O)CC4=CC=CC(=C4)C

InChI

InChI=1S/C26H24N2O2S/c1-18-12-14-23(15-13-18)31-25-20(3)27-28(22-10-5-4-6-11-22)26(25)30-24(29)17-21-9-7-8-19(2)16-21/h4-16H,17H2,1-3H3