Vitas-M small molecule compound
4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK363657
SMILES N#CC1=C(C)NC2=C(C1c1cc(Br)c(c(c1)OC)O)C(=O)CC(C2)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 C24H21BrN2O3 MW 465.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21BrN2O3/c1-13-17(12-26)22(16-8-18(25)24(29)21(11-16)30-2)23-19(27-13)9-15(10-20(23)28)14-6-4-3-5-7-14/h3-8,11,15,22,27,29H,9-10H2,1-2H3InChIKey
VUUSIJZLBUZBKI-UHFFFAOYSA-NSynonyms
4(3bromo4hydroxy5methoxyphenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carbonitrile
4(3bromo4hydroxy5methoxyphenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carbonitrile
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC(=C(C(=C4)Br)O)OC)C#N
InChI=1SC24H21BrN2O3c11317(1226)22(16818(25)24(29)21(1116)302)2319(2713)915(1020(23)28)146435714h381115222729H910H212H3
MFCD01527927
ZINC000019770400
ZINC000019770403
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