Vitas-M small molecule compound
2-amino-1-(2,6-difluorophenyl)-4-(3-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK768758
SMILES COc1cccc(c1)C1C(=C(N)N(C2=C1C(=O)CC(C2)(C)C)c1c(F)cccc1F)C#N
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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 C25H23F2N3O2 MW 435.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23F2N3O2/c1-25(2)11-19-22(20(31)12-25)21(14-6-4-7-15(10-14)32-3)16(13-28)24(29)30(19)23-17(26)8-5-9-18(23)27/h4-10,21H,11-12,29H2,1-3H3InChIKey
YQUFMHXDKWNWEG-UHFFFAOYSA-NSynonyms
2amino1(26difluorophenyl)4(3methoxyphenyl)77dimethyl5oxo145678hexahydroquinoline3carbonitrile
2AMINO1(26DIFLUOROPHENYL)4(3METHOXYPHENYL)77DIMETHYL5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1(CC2=C(C(C(=C(N2C3=C(C=CC=C3F)F)N)C#N)C4=CC(=CC=C4)OC)C(=O)C1)C
InChI=1SC25H23F2N3O2c125(2)111922(20(31)1225)21(1464715(1014)323)16(1328)24(29)30(19)2317(26)85918(23)27h41021H111229H213H3
MFCD03308197
ZINC000000720224
ZINC000000720225
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