Vitas-M small molecule compound
7-(difluoromethyl)-N-(3-methoxy-5-nitrophenyl)-5-methyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Catalog ID
STK960797
SMILES COc1cc(NC(=O)c2nc3n(n2)C(CC(N3)C)C(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 C15H16F2N6O4 MW 382.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16F2N6O4/c1-7-3-11(12(16)17)22-15(18-7)20-13(21-22)14(24)19-8-4-9(23(25)26)6-10(5-8)27-2/h4-7,11-12H,3H2,1-2H3,(H,19,24)(H,18,20,21)InChIKey
VKTGJIUCGZITCL-UHFFFAOYSA-NSynonyms
7(difluoromethyl)N(3methoxy5nitrophenyl)5methyl1567tetrahydro(124)triazolo(15a)pyrimidine2carboxamide
7(difluoromethyl)N(3methoxy5nitrophenyl)5methyl4567tetrahydro(124)triazolo(15a)pyrimidine2carboxamide
CC1CC(N2C(=N1)N=C(N2)C(=O)NC3=CC(=CC(=C3)OC)(N+)(=O)(O))C(F)F
InChI=1SC15H16F2N6O4c17311(12(16)17)2215(187)2013(2122)14(24)19849(23(25)26)610(58)272h471112H3H212H3(H1924)(H182021)
MFCD02243165
ZINC000001071525
ZINC000001071532
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