Vitas-M small molecule compound
4-{3-[(4-iodophenoxy)methyl]-4-methoxyphenyl}-2,7,7-trimethyl-5-oxo-N-(pyridin-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Catalog ID
STL174262
SMILES COc1ccc(cc1COc1ccc(cc1)I)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)Nc1ccccn1
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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 C32H32IN3O4 MW 649.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32IN3O4/c1-19-28(31(38)36-27-7-5-6-14-34-27)29(30-24(35-19)16-32(2,3)17-25(30)37)20-8-13-26(39-4)21(15-20)18-40-23-11-9-22(33)10-12-23/h5-15,29,35H,16-18H2,1-4H3,(H,34,36,38)InChIKey
NORYLGBXJDLGSS-UHFFFAOYSA-NSynonyms
444933-25-94(3((4iodophenoxy)methyl)4methoxyphenyl)277trimethyl5oxoN(pyridin2yl)145678hexahydroquinoline3carboxamide
4(3((4iodophenoxy)methyl)4methoxyphenyl)277trimethyl5oxoNpyridin2yl1468tetrahydroquinoline3carboxamide
444933259
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3)OC)COC4=CC=C(C=C4)I)C(=O)NC5=CC=CC=N5
InChI=1SC32H32IN3O4c11928(31(38)3627756143427)29(3024(3519)1632(23)1725(30)37)2081326(394)21(1520)18402311922(33)101223h5152935H1618H214H3(H343638)
MFCD02606891
ZINC000150476815
ZINC000150476817
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