Vitas-M small molecule compound

(5Z)-5-{[5-(4-bromo-3-methylphenyl)furan-2-yl]methylidene}-1-cyclohexylpyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK365100
SMILES O=C1NC(=O)N(C(=O)/C/1=C\c1ccc(o1)c1ccc(c(c1)C)Br)C1CCCCC1

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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 C22H21BrN2O4 MW 457.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21BrN2O4/c1-13-11-14(7-9-18(13)23)19-10-8-16(29-19)12-17-20(26)24-22(28)25(21(17)27)15-5-3-2-4-6-15/h7-12,15H,2-6H2,1H3,(H,24,26,28)/b17-12-
InChIKey
XUBOKCMYWMEKBH-ATVHPVEESA-N
Synonyms

(5Z)5((5(4BROMO3METHYLPHENYL)FURAN2YL)METHYLIDENE)1CYCLOHEXYL13DIAZINANE246TRIONE
(5Z)5((5(4BROMO3METHYLPHENYL)FURAN2YL)METHYLIDENE)1CYCLOHEXYLPYRIMIDINE246(1H3H5H)TRIONE
5((5(4BROMO3METHYLPHENYL)(2FURYL))METHYLENE)1CYCLOHEXYL13DIHYDROPYRIMIDINE246TRIONE
CC1=C(C=CC(=C1)C2=CC=C(O2)C=C3C(=O)NC(=O)N(C3=O)C4CCCCC4)Br
InChI=1SC22H21BrN2O4c1131114(7918(13)23)1910816(2919)121720(26)2422(28)25(21(17)27)155324615h71215H26H21H3(H242628)b1712
MFCD02314452
O=C1NC(=O)N(C(=O)C1=Cc1ccc(o1)c1ccc(c(c1)C)Br)C1CCCCC1
ZINC000001088468
ZINC01088468
ZINC1088468

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Available files

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