Vitas-M small molecule compound
(5Z)-1-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)phenyl]-5-[4-(trifluoromethyl)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK172517
SMILES O=C1NC(=O)/C(=C/c2ccc(cc2)C(F)(F)F)/C(=O)N1c1ccc(cc1)C12CC3CC(C2)CC(C1)C3
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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 C28H25F3N2O3 MW 494.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25F3N2O3/c29-28(30,31)21-3-1-16(2-4-21)12-23-24(34)32-26(36)33(25(23)35)22-7-5-20(6-8-22)27-13-17-9-18(14-27)11-19(10-17)15-27/h1-8,12,17-19H,9-11,13-15H2,(H,32,34,36)/b23-12-InChIKey
PABFNVIIBHBIPH-FMCGGJTJSA-NSynonyms
(5Z)1(4(1adamantyl)phenyl)5((4(trifluoromethyl)phenyl)methylidene)13diazinane246trione
(5Z)1(4(tricyclo(3311~37~)dec1yl)phenyl)5(4(trifluoromethyl)benzylidene)pyrimidine246(1H3H5H)trione
C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)N5C(=O)C(=CC6=CC=C(C=C6)C(F)(F)F)C(=O)NC5=O
InChI=1SC28H25F3N2O3c2928(3031)213116(2421)122324(34)3226(36)33(25(23)35)227520(6822)271317918(1427)1119(1017)1527h18121719H9111315H2(H323436)b2312
MFCD06150712
O=C1NC(=O)C(=Cc2ccc(cc2)C(F)(F)F)C(=O)N1c1ccc(cc1)C12CC3CC(C2)CC(C1)C3
ZINC000009323978
ZINC09323978
ZINC9323978
Check stock
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Check stock on Vitas-MAvailable files
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