3-tert-butyl-5-(tert-butylsulfanylmethyl)-1H-pyrazole

Systemtic Name: 3-tert-butyl-5-(tert-butylsulfanylmethyl)-1H-pyrazole Openeye Name: 3-tert-butyl-5-(tert-butylsulfanylmethyl)-1H-pyrazole CAS Name: 3-tert-butyl-5-[(tert-butylthio)methyl]-1H-pyrazole IUPAC Name: 3-tert-butyl-5-(tert-butylsulfanylmethyl)-1H-pyrazole Traditional Name: 3-tert-butyl-5-[(tert-butylthio)methyl]-1H-pyrazole Formula: C12H22N2S MolecularWeight: 226.38148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NNC(=C1)CSC(C)(C)C

Isomeric SMILES

CC(C)(C)C1=NNC(=C1)CSC(C)(C)C

InChI

InChI=1S/C12H22N2S/c1-11(2,3)10-7-9(13-14-10)8-15-12(4,5)6/h7H,8H2,1-6H3,(H,13,14)