Vitas-M small molecule compound
2-amino-4-{4-methoxy-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Catalog ID
STK957504
SMILES COc1ccc(cc1COCC(F)(F)F)c1c(C#N)c(N)nc2c1CCCC2
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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 C20H20F3N3O2 MW 391.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20F3N3O2/c1-27-17-7-6-12(8-13(17)10-28-11-20(21,22)23)18-14-4-2-3-5-16(14)26-19(25)15(18)9-24/h6-8H,2-5,10-11H2,1H3,(H2,25,26)InChIKey
SYQHYZSWHICRRC-UHFFFAOYSA-NSynonyms
352684-00-52amino4(4methoxy3((222trifluoroethoxy)methyl)phenyl)5678tetrahydroquinoline3carbonitrile
2amino4(4methoxy3(222trifluoroethoxymethyl)phenyl)5678tetrahydroquinoline3carbonitrile
352684005
COC1=C(C=C(C=C1)C2=C(C(=NC3=C2CCCC3)N)C#N)COCC(F)(F)F
InChI=1SC20H20F3N3O2c127177612(813(17)10281120(2122)23)1814423516(14)2619(25)15(18)924h68H251011H21H3(H22526)
MFCD01449808
ZINC000020477618
ZINC20477618
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