Vitas-M small molecule compound
benzyl 1,6-dimethyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK387350
SMILES O=C1NC(c2cccc(c2)[N+](=O)[O-])C(=C(N1C)C)C(=O)OCc1ccccc1
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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 C20H19N3O5 MW 381.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O5/c1-13-17(19(24)28-12-14-7-4-3-5-8-14)18(21-20(25)22(13)2)15-9-6-10-16(11-15)23(26)27/h3-11,18H,12H2,1-2H3,(H,21,25)InChIKey
BIJFKIAHWPDKMW-UHFFFAOYSA-NSynonyms
303140-24-1303140241
benzyl16dimethyl4(3nitrophenyl)2oxo1234tetrahydropyrimidine5carboxylate
BENZYL34DIMETHYL6(3NITROPHENYL)2OXO16DIHYDROPYRIMIDINE5CARBOXYLATE
CC1=C(C(NC(=O)N1C)C2=CC(=CC=C2)(N+)(=O)(O))C(=O)OCC3=CC=CC=C3
InChI=1SC20H19N3O5c11317(19(24)2812147435814)18(2120(25)22(13)2)15961016(1115)23(26)27h31118H12H212H3(H2125)
MFCD01151981
O=C1NC(c2cccc(c2)(N+)(=O)(O))C(=C(N1C)C)C(=O)OCc1ccccc1
PHENYLMETHYL34DIMETHYL6(3NITROPHENYL)2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
ZINC000000831858
ZINC000000831859
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