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

Systemtic Name: 1-[4-(4-chlorophenyl)sulfanyl-3,5-dimethyl-pyrazol-1-yl]-2-(4-methylphenoxy)ethanone Openeye Name: 1-[4-(4-chlorophenyl)sulfanyl-3,5-dimethyl-pyrazol-1-yl]-2-(4-methylphenoxy)ethanone CAS Name: 1-[4-[(4-chlorophenyl)thio]-3,5-dimethyl-1-pyrazolyl]-2-(4-methylphenoxy)ethanone IUPAC Name: 1-[4-(4-chlorophenyl)sulfanyl-3,5-dimethylpyrazol-1-yl]-2-(4-methylphenoxy)ethanone Traditional Name: 1-[4-[(4-chlorophenyl)thio]-3,5-dimethyl-pyrazol-1-yl]-2-(4-methylphenoxy)ethanone Formula: C20H19ClN2O2S MolecularWeight: 386.89506

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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)Cl)C

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClN2O2S/c1-13-4-8-17(9-5-13)25-12-19(24)23-15(3)20(14(2)22-23)26-18-10-6-16(21)7-11-18/h4-11H,12H2,1-3H3