Vitas-M small molecule compound
2-amino-1-(2,4-dimethoxyphenyl)-4-(4-fluorophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK760980
SMILES N#CC1=C(N)N(C2=C(C1c1ccc(cc1)F)C(=O)CC(C2)(C)C)c1ccc(cc1OC)OC
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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 C26H26FN3O3 MW 447.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26FN3O3/c1-26(2)12-20-24(21(31)13-26)23(15-5-7-16(27)8-6-15)18(14-28)25(29)30(20)19-10-9-17(32-3)11-22(19)33-4/h5-11,23H,12-13,29H2,1-4H3InChIKey
UNHLTOUVOCVXGK-UHFFFAOYSA-NSynonyms
2amino1(24dimethoxyphenyl)4(4fluorophenyl)77dimethyl5oxo145678hexahydroquinoline3carbonitrile
2AMINO1(24DIMETHOXYPHENYL)4(4FLUOROPHENYL)77DIMETHYL5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1(CC2=C(C(C(=C(N2C3=C(C=C(C=C3)OC)OC)N)C#N)C4=CC=C(C=C4)F)C(=O)C1)C
InChI=1SC26H26FN3O3c126(2)122024(21(31)1326)23(155716(27)8615)18(1428)25(29)30(20)1910917(323)1122(19)334h51123H121329H214H3
MFCD01820259
ZINC000000707310
ZINC000000707311
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