Vitas-M small molecule compound
3-bromopropyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK371880
SMILES BrCCCOC(=O)C1=C(C)NC(=O)NC1c1ccc2c(c1)OCO2
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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 C16H17BrN2O5 MW 397.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17BrN2O5/c1-9-13(15(20)22-6-2-5-17)14(19-16(21)18-9)10-3-4-11-12(7-10)24-8-23-11/h3-4,7,14H,2,5-6,8H2,1H3,(H2,18,19,21)InChIKey
JOBIZEPBSRBTAF-UHFFFAOYSA-NSynonyms
298706-79-3298706793
3bromopropyl4(13benzodioxol5yl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
3bromopropyl4(benzo(d)(13)dioxol5yl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
CC1=C(C(NC(=O)N1)C2=CC3=C(C=C2)OCO3)C(=O)OCCCBr
InChI=1SC16H17BrN2O5c1913(15(20)2262517)14(1916(21)189)10341112(710)2482311h34714H2568H21H3(H2181921)
MFCD00619559
ZINC000004083933
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