Vitas-M small molecule compound
5-[2-(3,4-dimethoxyphenyl)ethyl]-4-pentyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STK891284
SMILES CCCCCn1c(CCc2ccc(c(c2)OC)OC)nnc1S
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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 C17H25N3O2S MW 335.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25N3O2S/c1-4-5-6-11-20-16(18-19-17(20)23)10-8-13-7-9-14(21-2)15(12-13)22-3/h7,9,12H,4-6,8,10-11H2,1-3H3,(H,19,23)InChIKey
SDYLBLMJZDSUCW-UHFFFAOYSA-NSynonyms
951902-39-93(2(34dimethoxyphenyl)ethyl)4pentyl1H124triazole5thione
5(2(34dimethoxyphenyl)ethyl)4pentyl4H124triazole3thiol
951902399
CCCCCN1C(=NNC1=S)CCC2=CC(=C(C=C2)OC)OC
InChI=1SC17H25N3O2Sc1456112016(181917(20)23)108137914(212)15(1213)223h7912H4681011H213H3(H1923)
MFCD09983440
ZINC000011692631
ZINC11692631
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