Vitas-M small molecule compound
cyclopentyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK023753
SMILES COc1cc(cc(c1O)[N+](=O)[O-])C1NC(=O)NC(=C1C(=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 C18H21N3O7 MW 391.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O7/c1-9-14(17(23)28-11-5-3-4-6-11)15(20-18(24)19-9)10-7-12(21(25)26)16(22)13(8-10)27-2/h7-8,11,15,22H,3-6H2,1-2H3,(H2,19,20,24)InChIKey
QOMAINVCEJVRIL-UHFFFAOYSA-NSynonyms
364612-06-6364612066
CC1=C(C(NC(=O)N1)C2=CC(=C(C(=C2)OC)O)(N+)(=O)(O))C(=O)OC3CCCC3
COc1cc(cc(c1O)(N+)(=O)(O))C1NC(=O)NC(=C1C(=O)OC1CCCC1)C
cyclopentyl4(4hydroxy3methoxy5nitrophenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
CYCLOPENTYL4(4HYDROXY3METHOXY5NITROPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC18H21N3O7c1914(17(23)2811534611)15(2018(24)199)10712(21(25)26)16(22)13(810)272h78111522H36H212H3(H2192024)
MFCD03145185
STK023753
ZINC000035608229
ZINC000035608231
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