Vitas-M small molecule compound
6-benzyl-3-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1,2,4-triazin-5-ol
Catalog ID
STK618386
SMILES Oc1nc(SCc2nnnn2c2cccc(c2)C(F)(F)F)nnc1Cc1ccccc1
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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 C19H14F3N7OS MW 445.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14F3N7OS/c20-19(21,22)13-7-4-8-14(10-13)29-16(25-27-28-29)11-31-18-23-17(30)15(24-26-18)9-12-5-2-1-3-6-12/h1-8,10H,9,11H2,(H,23,26,30)InChIKey
NMVKYOWDPDGKDH-UHFFFAOYSA-NSynonyms
912899-46-86benzyl3(((1(3(trifluoromethyl)phenyl)1Htetrazol5yl)methyl)sulfanyl)124triazin5ol
6benzyl3(((1(3(trifluoromethyl)phenyl)1Htetrazol5yl)methyl)thio)124triazin5ol
6benzyl3((1(3(trifluoromethyl)phenyl)tetrazol5yl)methylsulfanyl)2H124triazin5one
912899468
C1=CC=C(C=C1)CC2=NNC(=NC2=O)SCC3=NN=NN3C4=CC=CC(=C4)C(F)(F)F
InChI=1SC19H14F3N7OSc2019(2122)1374814(1013)2916(25272829)1131182317(30)15(242618)9125213612h1810H911H2(H232630)
MFCD08745993
ZINC000009302601
ZINC9302601
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