Vitas-M small molecule compound
2-(benzylsulfanyl)-5-oxo-N-[2-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
Catalog ID
STK232289
SMILES O=C1Nc2nc(nn2C(C1)C(=O)Nc1ccccc1C(F)(F)F)SCc1ccccc1
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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 C20H16F3N5O2S MW 447.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16F3N5O2S/c21-20(22,23)13-8-4-5-9-14(13)24-17(30)15-10-16(29)25-18-26-19(27-28(15)18)31-11-12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H,24,30)(H,25,26,27,29)InChIKey
RIHMUIJIBRWGEU-UHFFFAOYSA-NSynonyms
2(benzylsulfanyl)5oxoN(2(trifluoromethyl)phenyl)4567tetrahydro(124)triazolo(15a)pyrimidine7carboxamide
2benzylsulfanyl5oxoN(2(trifluoromethyl)phenyl)67dihydro1H(124)triazolo(15a)pyrimidine7carboxamide
C1C(N2C(=NC1=O)N=C(N2)SCC3=CC=CC=C3)C(=O)NC4=CC=CC=C4C(F)(F)F
InChI=1SC20H16F3N5O2Sc2120(2223)13845914(13)2417(30)151016(29)25182619(2728(15)18)3111126213712h1915H1011H2(H2430)(H25262729)
MFCD08088722
ZINC000009427131
ZINC000009427132
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