Vitas-M small molecule compound
ethyl 6-methyl-4-(3-nitrophenyl)-2-oxo-3-(phenylacetyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK780873
SMILES CCOC(=O)C1=C(C)NC(=O)N(C1c1cccc(c1)[N+](=O)[O-])C(=O)Cc1ccccc1
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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 C22H21N3O6 MW 423.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O6/c1-3-31-21(27)19-14(2)23-22(28)24(18(26)12-15-8-5-4-6-9-15)20(19)16-10-7-11-17(13-16)25(29)30/h4-11,13,20H,3,12H2,1-2H3,(H,23,28)InChIKey
YXWCXUATMXLQMI-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C)NC(=O)N(C1c1cccc(c1)(N+)(=O)(O))C(=O)Cc1ccccc1
CCOC(=O)C1=C(NC(=O)N(C1C2=CC(=CC=C2)(N+)(=O)(O))C(=O)CC3=CC=CC=C3)C
ETHYL6METHYL4(3NITROPHENYL)2OXO3(2PHENYLACETYL)14DIHYDROPYRIMIDINE5CARBOXYLATE
ethyl6methyl4(3nitrophenyl)2oxo3(phenylacetyl)1234tetrahydropyrimidine5carboxylate
InChI=1SC22H21N3O6c133121(27)1914(2)2322(28)24(18(26)12158546915)20(19)161071117(1316)25(29)30h4111320H312H212H3(H2328)
MFCD06013769
ZINC000001432272
ZINC000001432273
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