Vitas-M small molecule compound
3-methylcyclohexyl 4-(6-bromo-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK371121
SMILES CC1CCCC(C1)OC(=O)C1=C(C)NC(=O)NC1c1cc2OCOc2cc1Br
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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 C20H23BrN2O5 MW 451.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23BrN2O5/c1-10-4-3-5-12(6-10)28-19(24)17-11(2)22-20(25)23-18(17)13-7-15-16(8-14(13)21)27-9-26-15/h7-8,10,12,18H,3-6,9H2,1-2H3,(H2,22,23,25)InChIKey
UXTDAXHFIINMMW-UHFFFAOYSA-NSynonyms
(3METHYLCYCLOHEXYL)4(6BROMO13BENZODIOXOL5YL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
3METHYLCYCLOHEXYL4(2BROMO45METHYLENEDIOXYPHENYL)34DIHYDRO6METHYL2(1H)OXO5PYRIMIDINECARBOXYLATE
3methylcyclohexyl4(6bromo13benzodioxol5yl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
3METHYLCYCLOHEXYL6(6BROMO(2HBENZO(D)13DIOXOLEN5YL))4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
CC1CCCC(C1)OC(=O)C2=C(NC(=O)NC2C3=CC4=C(C=C3Br)OCO4)C
InChI=1SC20H23BrN2O5c11043512(610)2819(24)1711(2)2220(25)2318(17)1371516(814(13)21)2792615h78101218H369H212H3(H2222325)
MFCD00352945
ZINC000004065341
ZINC000239425646
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