S-(4-methoxyphenyl) 1-[[2,6-bis(chloranyl)phenyl]methyl]-5-methyl-pyrazole-3-carbothioate

Systemtic Name: S-(4-methoxyphenyl) 1-[[2,6-bis(chloranyl)phenyl]methyl]-5-methyl-pyrazole-3-carbothioate Openeye Name: S-(4-methoxyphenyl) 1-[(2,6-dichlorophenyl)methyl]-5-methyl-pyrazole-3-carbothioate CAS Name: 1-[(2,6-dichlorophenyl)methyl]-5-methyl-3-pyrazolecarbothioic acid S-(4-methoxyphenyl) ester IUPAC Name: S-(4-methoxyphenyl) 1-[(2,6-dichlorophenyl)methyl]-5-methylpyrazole-3-carbothioate Traditional Name: 1-(2,6-dichlorobenzyl)-5-methyl-pyrazole-3-carbothioic acid S-(4-methoxyphenyl) ester Formula: C19H16Cl2N2O2S MolecularWeight: 407.31354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=C(C=CC=C2Cl)Cl)C(=O)SC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=NN1CC2=C(C=CC=C2Cl)Cl)C(=O)SC3=CC=C(C=C3)OC

InChI

InChI=1S/C19H16Cl2N2O2S/c1-12-10-18(19(24)26-14-8-6-13(25-2)7-9-14)22-23(12)11-15-16(20)4-3-5-17(15)21/h3-10H,11H2,1-2H3