Vitas-M small molecule compound
ethyl 6-methyl-4-[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL353152
SMILES CCOC(=O)C1=C(C)NC(=O)NC1c1cn(nc1c1cccc(c1)[N+](=O)[O-])c1ccccc1
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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 C23H21N5O5 MW 447.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N5O5/c1-3-33-22(29)19-14(2)24-23(30)25-21(19)18-13-27(16-9-5-4-6-10-16)26-20(18)15-8-7-11-17(12-15)28(31)32/h4-13,21H,3H2,1-2H3,(H2,24,25,30)InChIKey
DAMNVJOBJCXKHJ-UHFFFAOYSA-NSynonyms
312601-68-6312601686
CCOC(=O)C1=C(C)NC(=O)NC1c1cn(nc1c1cccc(c1)(N+)(=O)(O))c1ccccc1
CCOC(=O)C1=C(NC(=O)NC1C2=CN(N=C2C3=CC(=CC=C3)(N+)(=O)(O))C4=CC=CC=C4)C
ETHYL4METHYL6(3(3NITROPHENYL)1PHENYLPYRAZOL4YL)2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
ethyl6methyl4(3(3nitrophenyl)1phenyl1Hpyrazol4yl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL6METHYL4(3(3NITROPHENYL)1PHENYLPYRAZOL4YL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC23H21N5O5c133322(29)1914(2)2423(30)2521(19)181327(1695461016)2620(18)15871117(1215)28(31)32h41321H3H212H3(H2242530)
MFCD01458691
ZINC000001188579
ZINC000001188583
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