Vitas-M small molecule compound
methyl 4-[2-(difluoromethoxy)-5-nitrophenyl]-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL091255
SMILES COC(=O)C1=C(C)N(C)C(=O)NC1c1cc(ccc1OC(F)F)[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 C15H15F2N3O6 MW 371.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15F2N3O6/c1-7-11(13(21)25-3)12(18-15(22)19(7)2)9-6-8(20(23)24)4-5-10(9)26-14(16)17/h4-6,12,14H,1-3H3,(H,18,22)InChIKey
YBKFDPBXGCHRAX-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=O)N1C)C2=C(C=CC(=C2)(N+)(=O)(O))OC(F)F)C(=O)OC
COC(=O)C1=C(C)N(C)C(=O)NC1c1cc(ccc1OC(F)F)(N+)(=O)(O)
InChI=1SC15H15F2N3O6c1711(13(21)253)12(1815(22)19(7)2)968(20(23)24)4510(9)2614(16)17h461214H13H3(H1822)
methyl4(2(difluoromethoxy)5nitrophenyl)16dimethyl2oxo1234tetrahydropyrimidine5carboxylate
METHYL6(2(DIFLUOROMETHOXY)5NITROPHENYL)34DIMETHYL2OXO16DIHYDROPYRIMIDINE5CARBOXYLATE
MFCD06669270
ZINC000001105689
ZINC000001105690
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