Vitas-M small molecule compound
cyclopentyl 4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK364121
SMILES O=C1NC(=C(C(N1)c1ccc(c(c1)[N+](=O)[O-])O)C(=O)OC1CCCC1)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 C17H19N3O6 MW 361.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O6/c1-9-14(16(22)26-11-4-2-3-5-11)15(19-17(23)18-9)10-6-7-13(21)12(8-10)20(24)25/h6-8,11,15,21H,2-5H2,1H3,(H2,18,19,23)InChIKey
CKAWYPVHDYMUOJ-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=O)N1)C2=CC(=C(C=C2)O)(N+)(=O)(O))C(=O)OC3CCCC3
cyclopentyl4(4hydroxy3nitrophenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
CYCLOPENTYL4(4HYDROXY3NITROPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CYCLOPENTYL6(4HYDROXY3NITROPHENYL)4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC17H19N3O6c1914(16(22)2611423511)15(1917(23)189)106713(21)12(810)20(24)25h68111521H25H21H3(H2181923)
MFCD00366420
O=C1NC(=C(C(N1)c1ccc(c(c1)(N+)(=O)(O))O)C(=O)OC1CCCC1)C
ZINC000036144757
ZINC000036144758
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