Vitas-M small molecule compound
7-(difluoromethyl)-5-methyl-N-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Catalog ID
STK961254
SMILES CC1Nc2nc(nn2C(C1)C(F)F)C(=O)Nc1cc(OCC(F)(F)F)cc(c1)[N+](=O)[O-]
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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 C16H15F5N6O4 MW 450.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15F5N6O4/c1-7-2-11(12(17)18)26-15(22-7)24-13(25-26)14(28)23-8-3-9(27(29)30)5-10(4-8)31-6-16(19,20)21/h3-5,7,11-12H,2,6H2,1H3,(H,23,28)(H,22,24,25)InChIKey
VRWLIXFCBXMBLR-UHFFFAOYSA-NSynonyms
515858-34-1515858341
7(difluoromethyl)5methylN(3nitro5(222trifluoroethoxy)phenyl)1567tetrahydro(124)triazolo(15a)pyrimidine2carboxamide
7(difluoromethyl)5methylN(3nitro5(222trifluoroethoxy)phenyl)4567tetrahydro(124)triazolo(15a)pyrimidine2carboxamide
CC1CC(N2C(=N1)N=C(N2)C(=O)NC3=CC(=CC(=C3)OCC(F)(F)F)(N+)(=O)(O))C(F)F
InChI=1SC16H15F5N6O4c17211(12(17)18)2615(227)2413(2526)14(28)23839(27(29)30)510(48)31616(1920)21h3571112H26H21H3(H2328)(H222425)
MFCD02373484
ZINC000001005625
ZINC000001005628
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