Vitas-M small molecule compound
4-(4-ethylphenyl)-5-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK307069
SMILES CCc1ccc(cc1)n1c(S)nnc1c1cccc(c1)OC(C(F)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/c1-2-11-6-8-13(9-7-11)25-15(23-24-17(25)27)12-4-3-5-14(10-12)26-18(21,22)16(19)20/h3-10,16H,2H2,1H3,(H,24,27)InChIKey
MRDXOJVXXGAVNS-UHFFFAOYSA-NSynonyms
828287-63-44(4ethylphenyl)3(3(1122tetrafluoroethoxy)phenyl)1H124triazole5thione
4(4ethylphenyl)5(3(1122tetrafluoroethoxy)phenyl)4H124triazole3thiol
828287634
CCC1=CC=C(C=C1)N2C(=NNC2=S)C3=CC(=CC=C3)OC(C(F)F)(F)F
InChI=1SC18H15F4N3OSc12116813(9711)2515(232417(25)27)1243514(1012)2618(2122)16(19)20h31016H2H21H3(H2427)
MFCD04047778
ZINC000006419026
ZINC6419026
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