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

Systemtic Name: 1-[4-(4-chlorophenyl)sulfanyl-3,5-dimethyl-pyrazol-1-yl]-2-(2,4-dimethylphenoxy)ethanone Openeye Name: 1-[4-(4-chlorophenyl)sulfanyl-3,5-dimethyl-pyrazol-1-yl]-2-(2,4-dimethylphenoxy)ethanone CAS Name: 1-[4-[(4-chlorophenyl)thio]-3,5-dimethyl-1-pyrazolyl]-2-(2,4-dimethylphenoxy)ethanone IUPAC Name: 1-[4-(4-chlorophenyl)sulfanyl-3,5-dimethylpyrazol-1-yl]-2-(2,4-dimethylphenoxy)ethanone Traditional Name: 1-[4-[(4-chlorophenyl)thio]-3,5-dimethyl-pyrazol-1-yl]-2-(2,4-dimethylphenoxy)ethanone Formula: C21H21ClN2O2S MolecularWeight: 400.92164

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN2O2S/c1-13-5-10-19(14(2)11-13)26-12-20(25)24-16(4)21(15(3)23-24)27-18-8-6-17(22)7-9-18/h5-11H,12H2,1-4H3