Vitas-M small molecule compound

4-(2,3-dimethylphenyl)-5-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-4H-1,2,4-triazole-3-thiol

Catalog ID
STK306935
SMILES FC(C(Oc1cccc(c1)c1nnc(n1c1cccc(c1C)C)S)(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 C18H15F4N3OS MW 397.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15F4N3OS/c1-10-5-3-8-14(11(10)2)25-15(23-24-17(25)27)12-6-4-7-13(9-12)26-18(21,22)16(19)20/h3-9,16H,1-2H3,(H,24,27)
InChIKey
YOYIJBQSFBRJKN-UHFFFAOYSA-N
Synonyms
828286-37-9
4(23dimethylphenyl)3(3(1122tetrafluoroethoxy)phenyl)1H124triazole5thione
4(23dimethylphenyl)5(3(1122tetrafluoroethoxy)phenyl)4H124triazole3thiol
828286379
CC1=C(C(=CC=C1)N2C(=NNC2=S)C3=CC(=CC=C3)OC(C(F)F)(F)F)C
InChI=1SC18H15F4N3OSc11053814(11(10)2)2515(232417(25)27)1264713(912)2618(2122)16(19)20h3916H12H3(H2427)
MFCD04053645
ZINC000002792243
ZINC2792243

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Available files

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