Vitas-M small molecule compound
5-[(2-chlorophenoxy)methyl]-4-pentyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STK946055
SMILES CCCCCn1c(nnc1S)COc1ccccc1Cl
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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 C14H18ClN3OS MW 311.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18ClN3OS/c1-2-3-6-9-18-13(16-17-14(18)20)10-19-12-8-5-4-7-11(12)15/h4-5,7-8H,2-3,6,9-10H2,1H3,(H,17,20)InChIKey
PTABUONLHCOOBG-UHFFFAOYSA-NSynonyms
942864-91-73((2chlorophenoxy)methyl)4pentyl1H124triazole5thione
5((2chlorophenoxy)methyl)4pentyl4H124triazole3thiol
942864917
CCCCCN1C(=NNC1=S)COC2=CC=CC=C2Cl
InChI=1SC14H18ClN3OSc123691813(161714(18)20)101912854711(12)15h4578H236910H21H3(H1720)
MFCD09983416
ZINC000011692599
ZINC11692599
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