Vitas-M small molecule compound
4-(5-bromo-2-fluorophenyl)-2,7,7-trimethyl-5-oxo-N-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Catalog ID
STK406104
SMILES Brc1ccc(c(c1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)Nc1ccccc1)F
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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 C25H24BrFN2O2 MW 483.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24BrFN2O2/c1-14-21(24(31)29-16-7-5-4-6-8-16)22(17-11-15(26)9-10-18(17)27)23-19(28-14)12-25(2,3)13-20(23)30/h4-11,22,28H,12-13H2,1-3H3,(H,29,31)InChIKey
DKCQRACCIACMCJ-UHFFFAOYSA-NSynonyms
4(5bromo2fluorophenyl)277trimethyl5oxoNphenyl145678hexahydroquinoline3carboxamide
4(5bromo2fluorophenyl)277trimethyl5oxoNphenyl1468tetrahydroquinoline3carboxamide
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=C(C=CC(=C3)Br)F)C(=O)NC4=CC=CC=C4
InChI=1SC25H24BrFN2O2c11421(24(31)29167546816)22(171115(26)91018(17)27)2319(2814)1225(23)1320(23)30h4112228H1213H213H3(H2931)
MFCD04216291
ZINC000001129690
ZINC000016294012
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