(2-tert-butyl-5-methyl-4-phenylsulfanyl-pyrazol-3-yl) 2-(4-chloranylphenoxy)ethanoate

Systemtic Name: (2-tert-butyl-5-methyl-4-phenylsulfanyl-pyrazol-3-yl) 2-(4-chloranylphenoxy)ethanoate Openeye Name: (2-tert-butyl-5-methyl-4-phenylsulfanyl-pyrazol-3-yl) 2-(4-chlorophenoxy)acetate CAS Name: 2-(4-chlorophenoxy)acetic acid [2-tert-butyl-5-methyl-4-(phenylthio)-3-pyrazolyl] ester IUPAC Name: (2-tert-butyl-5-methyl-4-phenylsulfanylpyrazol-3-yl) 2-(4-chlorophenoxy)acetate Traditional Name: 2-(4-chlorophenoxy)acetic acid [2-tert-butyl-5-methyl-4-(phenylthio)pyrazol-3-yl] ester Formula: C22H23ClN2O3S MolecularWeight: 430.94762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1SC2=CC=CC=C2)OC(=O)COC3=CC=C(C=C3)Cl)C(C)(C)C

Isomeric SMILES

CC1=NN(C(=C1SC2=CC=CC=C2)OC(=O)COC3=CC=C(C=C3)Cl)C(C)(C)C

InChI

InChI=1S/C22H23ClN2O3S/c1-15-20(29-18-8-6-5-7-9-18)21(25(24-15)22(2,3)4)28-19(26)14-27-17-12-10-16(23)11-13-17/h5-13H,14H2,1-4H3