1-[3,5-dimethyl-4-(4-methylphenyl)sulfanyl-pyrazol-1-yl]-2-(4-methylphenoxy)ethanone

Systemtic Name: 1-[3,5-dimethyl-4-(4-methylphenyl)sulfanyl-pyrazol-1-yl]-2-(4-methylphenoxy)ethanone Openeye Name: 1-[3,5-dimethyl-4-(p-tolylsulfanyl)pyrazol-1-yl]-2-(4-methylphenoxy)ethanone CAS Name: 1-[3,5-dimethyl-4-[(4-methylphenyl)thio]-1-pyrazolyl]-2-(4-methylphenoxy)ethanone IUPAC Name: 1-[3,5-dimethyl-4-(4-methylphenyl)sulfanylpyrazol-1-yl]-2-(4-methylphenoxy)ethanone Traditional Name: 1-[3,5-dimethyl-4-(p-tolylthio)pyrazol-1-yl]-2-(4-methylphenoxy)ethanone Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(=O)N2C(=C(C(=N2)C)SC3=CC=C(C=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)OCC(=O)N2C(=C(C(=N2)C)SC3=CC=C(C=C3)C)C

InChI

InChI=1S/C21H22N2O2S/c1-14-5-9-18(10-6-14)25-13-20(24)23-17(4)21(16(3)22-23)26-19-11-7-15(2)8-12-19/h5-12H,13H2,1-4H3