5-[(2,3,4,5,6-pentamethylphenyl)methylsulfanylmethyl]-4-[3-(trifluoromethyl)phenyl]-2H-1,2,4-triazole-3-thione dihydrate
Molecular Formula:
C22H28F3N3O2S2
InChI: InChI=1/C22H24F3N3S2.2H2O/c1-12-13(2)15(4)19(16(5)14(12)3)10-30-11-20-26-27-21(29)28(20)18-8-6-7-17(9-18)22(23,24)25;;/h6-9H,10-11H2,1-5H3,(H,27,29);2*1H2/f/h27H;;
InChIKey: InChIKey=HRTDZRZVOQLSOK-JDCQWMNVCW
SMILES: CC1=C(C(=C(C(=C1C)C)CSCC2=NNC(=S)N2C3=CC=CC(=C3)C(F)(F)F)C)C.O.O
Names:
5-[(2,3,4,5,6-pentamethylphenyl)methylsulfanylmethyl]-4-[3-(trifluoromethyl)phenyl]-2H-1,2,4-triazole-3-thione dihydrate
Registries:
PubChem CID 2807265
PubChem ID 3265205
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