Vitas-M small molecule compound
methyl 4-(3-bromo-5-chloro-2-methoxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK509232
SMILES COC(=O)C1=C(C)N(C)C(=O)NC1c1cc(Cl)cc(c1OC)Br
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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 C15H16BrClN2O4 MW 403.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16BrClN2O4/c1-7-11(14(20)23-4)12(18-15(21)19(7)2)9-5-8(17)6-10(16)13(9)22-3/h5-6,12H,1-4H3,(H,18,21)InChIKey
SSMLPGTXZUDWEH-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=O)N1C)C2=CC(=CC(=C2OC)Br)Cl)C(=O)OC
InChI=1SC15H16BrClN2O4c1711(14(20)234)12(1815(21)19(7)2)958(17)610(16)13(9)223h5612H14H3(H1821)
methyl4(3bromo5chloro2methoxyphenyl)16dimethyl2oxo1234tetrahydropyrimidine5carboxylate
methyl6(3bromo5chloro2methoxyphenyl)34dimethyl2oxo16dihydropyrimidine5carboxylate
MFCD04230695
ZINC000006849107
ZINC000006849219
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