Vitas-M small molecule compound

2-amino-4-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}phenyl)-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile

Catalog ID
STL174219
SMILES N#CC1=C(N)C(C(C2C1=CCCC2)c1ccc(c(c1)COc1cccc(c1)C(F)(F)F)OC)(C#N)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 C28H23F3N4O2 MW 504.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23F3N4O2/c1-36-24-10-9-17(11-18(24)14-37-20-6-4-5-19(12-20)28(29,30)31)25-22-8-3-2-7-21(22)23(13-32)26(35)27(25,15-33)16-34/h4-7,9-12,22,25H,2-3,8,14,35H2,1H3
InChIKey
XSDQNVBPDRIHCY-UHFFFAOYSA-N
Synonyms
445236-71-5
2AMINO4(4METHOXY3((3(TRIFLUOROMETHYL)PHENOXY)METHYL)PHENYL)4A567TETRAHYDRO133(4H)NAPHTHALENETRICARBONITRILE
2AMINO4(4METHOXY3((3(TRIFLUOROMETHYL)PHENOXY)METHYL)PHENYL)4A567TETRAHYDRO4HNAPHTHALENE133TRICARBONITRILE
2amino4(4methoxy3((3(trifluoromethyl)phenoxy)methyl)phenyl)4a567tetrahydronaphthalene133(4H)tricarbonitrile
445236715
COC1=C(C=C(C=C1)C2C3CCCC=C3C(=C(C2(C#N)C#N)N)C#N)COC4=CC=CC(=C4)C(F)(F)F
InChI=1SC28H23F3N4O2c1362410917(1118(24)14372064519(1220)28(2930)31)2522832721(22)23(1332)26(35)27(251533)1634h479122225H2381435H21H3
MFCD02373979
ZINC000000649354
ZINC000000649360

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Available files

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