Vitas-M small molecule compound
methyl 3-acetyl-6-methyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK794205
SMILES COC(=O)C1=C(C)NC(=O)N(C1c1cccc(c1)[N+](=O)[O-])C(=O)C
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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 C15H15N3O6 MW 333.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3O6/c1-8-12(14(20)24-3)13(17(9(2)19)15(21)16-8)10-5-4-6-11(7-10)18(22)23/h4-7,13H,1-3H3,(H,16,21)InChIKey
HLUJFRZXFQDWKC-UHFFFAOYSA-NSynonyms
CC1=C(C(N(C(=O)N1)C(=O)C)C2=CC(=CC=C2)(N+)(=O)(O))C(=O)OC
COC(=O)C1=C(C)NC(=O)N(C1c1cccc(c1)(N+)(=O)(O))C(=O)C
InChI=1SC15H15N3O6c1812(14(20)243)13(17(9(2)19)15(21)168)1054611(710)18(22)23h4713H13H3(H1621)
methyl3acetyl6methyl4(3nitrophenyl)2oxo1234tetrahydropyrimidine5carboxylate
METHYL3ACETYL6METHYL4(3NITROPHENYL)2OXO14DIHYDROPYRIMIDINE5CARBOXYLATE
MFCD00649087
ZINC000000083313
ZINC000000083321
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