Vitas-M small molecule compound
2-amino-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK755185
SMILES N#CC1=C(N)N(c2cccc(c2)C(F)(F)F)C2=C(C1c1ccc(c(c1)OC)OC)C(=O)CC(C2)(C)C
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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 C27H26F3N3O3 MW 497.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26F3N3O3/c1-26(2)12-19-24(20(34)13-26)23(15-8-9-21(35-3)22(10-15)36-4)18(14-31)25(32)33(19)17-7-5-6-16(11-17)27(28,29)30/h5-11,23H,12-13,32H2,1-4H3InChIKey
SXTRHTXADLIIBK-UHFFFAOYSA-NSynonyms
311328-69-52amino4(34dimethoxyphenyl)77dimethyl5oxo1(3(trifluoromethyl)phenyl)145678hexahydroquinoline3carbonitrile
2AMINO4(34DIMETHOXYPHENYL)77DIMETHYL5OXO1(3(TRIFLUOROMETHYL)PHENYL)68DIHYDRO4HQUINOLINE3CARBONITRILE
311328695
CC1(CC2=C(C(C(=C(N2C3=CC=CC(=C3)C(F)(F)F)N)C#N)C4=CC(=C(C=C4)OC)OC)C(=O)C1)C
InChI=1SC27H26F3N3O3c126(2)121924(20(34)1326)23(158921(353)22(1015)364)18(1431)25(32)33(19)1775616(1117)27(2829)30h51123H121332H214H3
MFCD00827456
ZINC000000713513
ZINC000000713514
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