Vitas-M small molecule compound
(5Z)-5-{[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-[4-(butan-2-yl)phenyl]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK551520
SMILES CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)Br)C)/C1=O)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 C27H26BrN3O3 MW 520.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26BrN3O3/c1-5-16(2)19-6-10-23(11-7-19)31-26(33)24(25(32)29-27(31)34)15-20-14-17(3)30(18(20)4)22-12-8-21(28)9-13-22/h6-16H,5H2,1-4H3,(H,29,32,34)/b24-15-InChIKey
XUXPYWHLIHKXGZ-IWIPYMOSSA-NSynonyms
799817-20-2(5Z)5((1(4bromophenyl)25dimethyl1Hpyrrol3yl)methylidene)1(4(butan2yl)phenyl)pyrimidine246(1H3H5H)trione
(5Z)5((1(4BROMOPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1(4BUTAN2YLPHENYL)13DIAZINANE246TRIONE
(Z)5((1(4bromophenyl)25dimethyl1Hpyrrol3yl)methylene)1(4(secbutyl)phenyl)pyrimidine246(1H3H5H)trione
799817202
CCC(C)C1=CC=C(C=C1)N2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC=C(C=C4)Br)C)C(=O)NC2=O
CCC(c1ccc(cc1)N1C(=O)NC(=O)C(=Cc2cc(n(c2C)c2ccc(cc2)Br)C)C1=O)C
InChI=1SC27H26BrN3O3c1516(2)1961023(11719)3126(33)24(25(32)2927(31)34)15201417(3)30(18(20)4)2212821(28)91322h616H5H214H3(H293234)b2415
MFCD03681177
ZINC000009428518
ZINC000009428519
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.