Vitas-M small molecule compound
6-(4-ethoxyphenyl)-3-methyl-N-[2-(trifluoromethyl)phenyl]-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL358956
SMILES CCOc1ccc(cc1)C1Nn2c(C)nnc2SC1C(=O)Nc1ccccc1C(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 C21H20F3N5O2S MW 463.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F3N5O2S/c1-3-31-14-10-8-13(9-11-14)17-18(32-20-27-26-12(2)29(20)28-17)19(30)25-16-7-5-4-6-15(16)21(22,23)24/h4-11,17-18,28H,3H2,1-2H3,(H,25,30)InChIKey
CWEMNPFRBPFGDN-UHFFFAOYSA-NSynonyms
874586-44-46(4ethoxyphenyl)3methylN(2(trifluoromethyl)phenyl)67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
874586444
CCOC1=CC=C(C=C1)C2C(SC3=NN=C(N3N2)C)C(=O)NC4=CC=CC=C4C(F)(F)F
InChI=1SC21H20F3N5O2Sc13311410813(91114)1718(3220272612(2)29(20)2817)19(30)2516754615(16)21(2223)24h411171828H3H212H3(H2530)
MFCD07433448
ZINC000009238881
ZINC000009238884
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