Vitas-M small molecule compound
6-phenyl-3-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]-1,2,4-triazin-5-ol
Catalog ID
STL235206
SMILES Oc1nc(SCc2nnnn2c2cccc(c2)C(F)(F)F)nnc1c1ccccc1
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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 C18H12F3N7OS MW 431.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12F3N7OS/c19-18(20,21)12-7-4-8-13(9-12)28-14(23-26-27-28)10-30-17-22-16(29)15(24-25-17)11-5-2-1-3-6-11/h1-9H,10H2,(H,22,25,29)InChIKey
KZEZARFVBKKXST-UHFFFAOYSA-NSynonyms
912899-04-86phenyl3(((1(3(trifluoromethyl)phenyl)1Htetrazol5yl)methyl)sulfanyl)124triazin5ol
6phenyl3(((1(3(trifluoromethyl)phenyl)1Htetrazol5yl)methyl)thio)124triazin5ol
6phenyl3((1(3(trifluoromethyl)phenyl)tetrazol5yl)methylsulfanyl)2H124triazin5one
912899048
C1=CC=C(C=C1)C2=NNC(=NC2=O)SCC3=NN=NN3C4=CC=CC(=C4)C(F)(F)F
InChI=1SC18H12F3N7OSc1918(2021)1274813(912)2814(23262728)1030172216(29)15(242517)115213611h19H10H2(H222529)
MFCD08748047
ZINC000013627512
ZINC13627512
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