Vitas-M small molecule compound
5-(4-ethoxyphenyl)-1-[3-(trifluoromethyl)benzyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Catalog ID
STL081467
SMILES CCOc1ccc(cc1)N1C(=O)C2C(C1=O)N=NN2Cc1cccc(c1)C(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 C20H17F3N4O3 MW 418.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17F3N4O3/c1-2-30-15-8-6-14(7-9-15)27-18(28)16-17(19(27)29)26(25-24-16)11-12-4-3-5-13(10-12)20(21,22)23/h3-10,16-17H,2,11H2,1H3InChIKey
SLMWVSVUBSLSDP-UHFFFAOYSA-NSynonyms
5(4ethoxyphenyl)1(3(trifluoromethyl)benzyl)3a6adihydropyrrolo(34d)(123)triazole46(1H5H)dione
5(4ethoxyphenyl)3((3(trifluoromethyl)phenyl)methyl)3a6adihydropyrrolo(34d)triazole46dione
CCOC1=CC=C(C=C1)N2C(=O)C3C(C2=O)N(N=N3)CC4=CC(=CC=C4)C(F)(F)F
InChI=1SC20H17F3N4O3c1230158614(7915)2718(28)1617(19(27)29)26(252416)111243513(1012)20(2122)23h3101617H211H21H3
MFCD14757261
ZINC000020215508
ZINC000101417831
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