Vitas-M small molecule compound
ethyl 6-(azepan-1-ylmethyl)-4-(3-bromophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL107611
SMILES CCOC(=O)C1=C(CN2CCCCCC2)NC(=O)NC1c1cccc(c1)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 C20H26BrN3O3 MW 436.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26BrN3O3/c1-2-27-19(25)17-16(13-24-10-5-3-4-6-11-24)22-20(26)23-18(17)14-8-7-9-15(21)12-14/h7-9,12,18H,2-6,10-11,13H2,1H3,(H2,22,23,26)InChIKey
PYKNNLBKGUDNLD-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC(=CC=C2)Br)CN3CCCCCC3
ethyl6(azepan1ylmethyl)4(3bromophenyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl6(azepan1ylmethyl)4(3bromophenyl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC20H26BrN3O3c122719(25)1716(13241053461124)2220(26)2318(17)1487915(21)1214h791218H26101113H21H3(H2222326)
MFCD20741547
ZINC000067286182
ZINC000067286184
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