Vitas-M small molecule compound
4-cyclohexyl-5-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STL173903
SMILES FC(C(Oc1cccc(c1)c1nnc(n1C1CCCCC1)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 C16H17F4N3OS MW 375.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17F4N3OS/c17-14(18)16(19,20)24-12-8-4-5-10(9-12)13-21-22-15(25)23(13)11-6-2-1-3-7-11/h4-5,8-9,11,14H,1-3,6-7H2,(H,22,25)InChIKey
OXSBHVMJPKQOQT-UHFFFAOYSA-NSynonyms
828280-26-84cyclohexyl3(3(1122tetrafluoroethoxy)phenyl)1H124triazole5thione
4cyclohexyl5(3(1122tetrafluoroethoxy)phenyl)4H124triazole3thiol
828280268
C1CCC(CC1)N2C(=NNC2=S)C3=CC(=CC=C3)OC(C(F)F)(F)F
InChI=1SC16H17F4N3OSc1714(18)16(1920)241284510(912)13212215(25)23(13)116213711h45891114H1367H2(H2225)
MFCD04056369
ZINC000002790927
ZINC02790927
ZINC2790927
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