Vitas-M small molecule compound
3-phenyl-2-(1H-tetrazol-1-yl)-1-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]propan-1-one
Catalog ID
STL423009
SMILES O=C(C(n1cnnn1)Cc1ccccc1)N1CCn2c(C1)nnc2C(F)(F)F
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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 C16H15F3N8O MW 392.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15F3N8O/c17-16(18,19)15-22-21-13-9-25(6-7-26(13)15)14(28)12(27-10-20-23-24-27)8-11-4-2-1-3-5-11/h1-5,10,12H,6-9H2InChIKey
CPSUXCKWPDELSC-UHFFFAOYSA-NSynonyms
(S)3phenyl2(1Htetrazol1yl)1(3(trifluoromethyl)56dihydro(124)triazolo(43a)pyrazin7(8H)yl)propan1one
3phenyl2(1Htetrazol1yl)1(3(trifluoromethyl)56dihydro(124)triazolo(43a)pyrazin7(8H)yl)propan1one
3phenyl2(tetrazol1yl)1(3(trifluoromethyl)68dihydro5H(124)triazolo(43a)pyrazin7yl)propan1one
C1CN2C(=NN=C2C(F)(F)F)CN1C(=O)C(CC3=CC=CC=C3)N4C=NN=N4
InChI=1SC16H15F3N8Oc1716(1819)15222113925(6726(13)15)14(28)12(271020232427)8114213511h151012H69H2
MFCD30708497
O=C((C@@H)(n1cnnn1)Cc1ccccc1)N1CCn2c(C1)nnc2C(F)(F)F
ZINC000170625359
ZINC000252481635
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