3-tert-butyl-5-methylsulfanyl-pyrazole-1-carbonyl chloride

Systemtic Name: 3-tert-butyl-5-methylsulfanyl-pyrazole-1-carbonyl chloride Openeye Name: 3-tert-butyl-5-methylsulfanyl-pyrazole-1-carbonyl chloride CAS Name: 3-tert-butyl-5-(methylthio)-1-pyrazolecarbonyl chloride IUPAC Name: 3-tert-butyl-5-methylsulfanylpyrazole-1-carbonyl chloride Traditional Name: 3-tert-butyl-5-(methylthio)pyrazole-1-carbonyl chloride Formula: C9H13ClN2OS MolecularWeight: 232.73032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)SC)C(=O)Cl

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)SC)C(=O)Cl

InChI

InChI=1S/C9H13ClN2OS/c1-9(2,3)6-5-7(14-4)12(11-6)8(10)13/h5H,1-4H3