Vitas-M small molecule compound
(5Z)-5-{3-bromo-5-ethoxy-4-[3-(4-methylphenoxy)propoxy]benzylidene}-1-(4-chlorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK058764
SMILES CCOc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)cc(c1OCCCOc1ccc(cc1)C)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 C29H26BrClN2O6 MW 613.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26BrClN2O6/c1-3-37-25-17-19(16-24(30)26(25)39-14-4-13-38-22-11-5-18(2)6-12-22)15-23-27(34)32-29(36)33(28(23)35)21-9-7-20(31)8-10-21/h5-12,15-17H,3-4,13-14H2,1-2H3,(H,32,34,36)/b23-15-InChIKey
TXDSOWWTTMNLKJ-HAHDFKILSA-NSynonyms
(5Z)5((3bromo5ethoxy4(3(4methylphenoxy)propoxy)phenyl)methylidene)1(4chlorophenyl)13diazinane246trione
(5Z)5(3BROMO5ETHOXY4(3(4METHYLPHENOXY)PROPOXY)BENZYLIDENE)1(4CHLOROPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Cl)Br)OCCCOC4=CC=C(C=C4)C
CCOc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)cc(c1OCCCOc1ccc(cc1)C)Br
InChI=1SC29H26BrClN2O6c1337251719(1624(30)26(25)3914413382211518(2)61222)152327(34)3229(36)33(28(23)35)219720(31)81021h5121517H341314H212H3(H323436)b2315
MFCD05976019
STK058764
ZINC000097958775
ZINC97958775
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