Vitas-M small molecule compound
2-methylpropyl 1,6-dimethyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK068508
SMILES CC(COC(=O)C1=C(C)N(C(=O)NC1c1cccc(c1)[N+](=O)[O-])C)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 C17H21N3O5 MW 347.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O5/c1-10(2)9-25-16(21)14-11(3)19(4)17(22)18-15(14)12-6-5-7-13(8-12)20(23)24/h5-8,10,15H,9H2,1-4H3,(H,18,22)InChIKey
LTFWCPVQIQEGIE-UHFFFAOYSA-NSynonyms
300712-93-02methylpropyl16dimethyl4(3nitrophenyl)2oxo1234tetrahydropyrimidine5carboxylate
2METHYLPROPYL34DIMETHYL6(3NITROPHENYL)2OXO16DIHYDROPYRIMIDINE5CARBOXYLATE
300712930
CC(COC(=O)C1=C(C)N(C(=O)NC1c1cccc(c1)(N+)(=O)(O))C)C
CC1=C(C(NC(=O)N1C)C2=CC(=CC=C2)(N+)(=O)(O))C(=O)OCC(C)C
InChI=1SC17H21N3O5c110(2)92516(21)1411(3)19(4)17(22)1815(14)1265713(812)20(23)24h581015H9H214H3(H1822)
MFCD00718224
STK068508
ZINC000000195678
ZINC000000195680
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