Vitas-M small molecule compound
5-(2-chloro-6-fluorobenzyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK444060
SMILES CCOc1ccc(cc1)n1c(S)nnc1Cc1c(F)cccc1Cl
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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 C17H15ClFN3OS MW 363.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15ClFN3OS/c1-2-23-12-8-6-11(7-9-12)22-16(20-21-17(22)24)10-13-14(18)4-3-5-15(13)19/h3-9H,2,10H2,1H3,(H,21,24)InChIKey
ASQGXMZWIJRIBP-UHFFFAOYSA-NSynonyms
3((2chloro6fluorophenyl)methyl)4(4ethoxyphenyl)1H124triazole5thione
5((2CHLORO6FLUOROPHENYL)METHYL)4(4ETHOXYPHENYL)124TRIAZOLE3THIOL
5(2chloro6fluorobenzyl)4(4ethoxyphenyl)4H124triazole3thiol
CCOC1=CC=C(C=C1)N2C(=NNC2=S)CC3=C(C=CC=C3Cl)F
InChI=1SC17H15ClFN3OSc1223128611(7912)2216(202117(22)24)101314(18)43515(13)19h39H210H21H3(H2124)
MFCD04055255
ZINC000006393694
ZINC06393694
ZINC6393694
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