Vitas-M small molecule compound

4-benzyl-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol

Catalog ID
STL399934
SMILES Sc1nnc(n1Cc1ccccc1)Cn1nc(cc1C)C(F)(F)F

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C15H14F3N5S MW 353.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14F3N5S/c1-10-7-12(15(16,17)18)21-23(10)9-13-19-20-14(24)22(13)8-11-5-3-2-4-6-11/h2-7H,8-9H2,1H3,(H,20,24)
InChIKey
YNVVBBAJKXFFPK-UHFFFAOYSA-N
Synonyms
957311-36-3
4BENZYL3((5METHYL3(TRIFLUOROMETHYL)PYRAZOL1YL)METHYL)1H124TRIAZOLE5THIONE
4BENZYL5((5METHYL3(TRIFLUOROMETHYL)1HPYRAZOL1YL)METHYL)4H124TRIAZOL3YLHYDROSULFIDE
4BENZYL5((5METHYL3(TRIFLUOROMETHYL)1HPYRAZOL1YL)METHYL)4H124TRIAZOLE3THIOL
957311363
CC1=CC(=NN1CC2=NNC(=S)N2CC3=CC=CC=C3)C(F)(F)F
InChI=1SC15H14F3N5Sc110712(15(1617)18)2123(10)913192014(24)22(13)8115324611h27H89H21H3(H2024)
MFCD04048238
ZINC000005442512
ZINC5442512

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Available files

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