Vitas-M small molecule compound

prop-2-en-1-yl 4-(6-bromo-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK016328
SMILES CC1=C(C(NC(=O)N1)c1cc2OCOc2cc1Br)C(=O)OCC=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 C16H15BrN2O5 MW 395.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15BrN2O5/c1-3-4-22-15(20)13-8(2)18-16(21)19-14(13)9-5-11-12(6-10(9)17)24-7-23-11/h3,5-6,14H,1,4,7H2,2H3,(H2,18,19,21)
InChIKey
ZYBJIUBMDUEKRW-UHFFFAOYSA-N
Synonyms

ALLYL4(2BROMO45METHYLENEDIOXYPHENYL)34DIHYDRO6METHYL2(1H)OXO5PYRIMIDINECARBOXYLATE
CC1=C(C(NC(=O)N1)c1cc2OCOc2cc1Br)C(=O)OCC=C
CC1=C(C(NC(=O)N1)C2=CC3=C(C=C2Br)OCO3)C(=O)OCC=C
InChI=1SC16H15BrN2O5c1342215(20)138(2)1816(21)1914(13)951112(610(9)17)2472311h35614H147H22H3(H2181921)
MFCD00391654
prop2en1yl4(6bromo13benzodioxol5yl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
PROP2ENYL4(6BROMO13BENZODIOXOL5YL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
PROP2ENYL6(6BROMO(2HBENZO(D)13DIOXOLEN5YL))4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
STK016328
ZINC000004017147
ZINC000004017148

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Available files

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