Vitas-M small molecule compound
methyl 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK509414
SMILES CCOc1c(Br)cc(cc1OC)C1NC(=O)N(C(=C1C(=O)OC)C)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 C17H21BrN2O5 MW 413.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21BrN2O5/c1-6-25-15-11(18)7-10(8-12(15)23-4)14-13(16(21)24-5)9(2)20(3)17(22)19-14/h7-8,14H,6H2,1-5H3,(H,19,22)InChIKey
KJSGRJVXIPZQEI-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1Br)C2C(=C(N(C(=O)N2)C)C)C(=O)OC)OC
InChI=1SC17H21BrN2O5c16251511(18)710(812(15)234)1413(16(21)245)9(2)20(3)17(22)1914h7814H6H215H3(H1922)
methyl4(3bromo4ethoxy5methoxyphenyl)16dimethyl2oxo1234tetrahydropyrimidine5carboxylate
METHYL6(3BROMO4ETHOXY5METHOXYPHENYL)34DIMETHYL2OXO16DIHYDROPYRIMIDINE5CARBOXYLATE
MFCD03080238
ZINC000000684082
ZINC000000684083
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