Vitas-M small molecule compound
2-amino-4-(3,4-dimethoxyphenyl)-5-oxo-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK756165
SMILES N#CC1=C(N)N(C2=C(C1c1ccc(c(c1)OC)OC)C(=O)CCC2)c1ccccc1C(F)(F)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 C25H22F3N3O3 MW 469.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22F3N3O3/c1-33-20-11-10-14(12-21(20)34-2)22-15(13-29)24(30)31(18-8-5-9-19(32)23(18)22)17-7-4-3-6-16(17)25(26,27)28/h3-4,6-7,10-12,22H,5,8-9,30H2,1-2H3InChIKey
JXJAOPMNHAYBJF-UHFFFAOYSA-NSynonyms
2amino4(34dimethoxyphenyl)5oxo1(2(trifluoromethyl)phenyl)145678hexahydroquinoline3carbonitrile
2amino4(34dimethoxyphenyl)5oxo1(2(trifluoromethyl)phenyl)4678tetrahydroquinoline3carbonitrile
COC1=C(C=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=CC=C4C(F)(F)F)N)C#N)OC
InChI=1SC25H22F3N3O3c13320111014(1221(20)342)2215(1329)24(30)31(1885919(32)23(18)22)17743616(17)25(2627)28h3467101222H58930H212H3
MFCD01304826
ZINC000000705623
ZINC000000705624
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