4-Isothiocyanato-3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazole

CAS Registry Number®

1004193-56-9
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CAS Name

4-Isothiocyanato-3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazole

Molecular Formula

C14H15N3S

Molecular Mass

257.35

Cite this Page

4-Isothiocyanato-3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1004193-56-9 (retrieved 2024-08-25) (CAS RN: 1004193-56-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H15N3S/c1-10-4-6-13(7-5-10)8-17-12(3)14(15-9-18)11(2)16-17/h4-7H,8H2,1-3H3

InChIKey

InChIKey=MGFYGDCCYJWADQ-UHFFFAOYSA-N

SMILES

C(N1C(C)=C(N=C=S)C(C)=N1)C2=CC=C(C)C=C2

Canonical SMILES

S=C=NC=1C(=NN(C1C)CC2=CC=C(C=C2)C)C

Other Names for this Substance

  • 1H-Pyrazole, 4-isothiocyanato-3,5-dimethyl-1-[(4-methylphenyl)methyl]-
  • 4-Isothiocyanato-3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazole