1-(4-methylsulfanylphenyl)-5-(4-methylsulfonylphenyl)pyrazole-3-carbonyl chloride

Systemtic Name: 1-(4-methylsulfanylphenyl)-5-(4-methylsulfonylphenyl)pyrazole-3-carbonyl chloride Openeye Name: 1-(4-methylsulfanylphenyl)-5-(4-methylsulfonylphenyl)pyrazole-3-carbonyl chloride CAS Name: 5-(4-methylsulfonylphenyl)-1-[4-(methylthio)phenyl]-3-pyrazolecarbonyl chloride IUPAC Name: 1-(4-methylsulfanylphenyl)-5-(4-methylsulfonylphenyl)pyrazole-3-carbonyl chloride Traditional Name: 5-(4-mesylphenyl)-1-[4-(methylthio)phenyl]pyrazole-3-carbonyl chloride Formula: C18H15ClN2O3S2 MolecularWeight: 406.9063

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2C(=CC(=N2)C(=O)Cl)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CSC1=CC=C(C=C1)N2C(=CC(=N2)C(=O)Cl)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C18H15ClN2O3S2/c1-25-14-7-5-13(6-8-14)21-17(11-16(20-21)18(19)22)12-3-9-15(10-4-12)26(2,23)24/h3-11H,1-2H3