Vitas-M small molecule compound
2-({[2-oxo-6-(propan-2-yl)-2H-chromen-4-yl]methyl}sulfanyl)-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Catalog ID
STL034974
SMILES N#Cc1c(SCc2cc(=O)oc3c2cc(cc3)C(C)C)nc2c(c1C(F)(F)F)CCCC2
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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 C24H21F3N2O2S MW 458.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21F3N2O2S/c1-13(2)14-7-8-20-17(9-14)15(10-21(30)31-20)12-32-23-18(11-28)22(24(25,26)27)16-5-3-4-6-19(16)29-23/h7-10,13H,3-6,12H2,1-2H3InChIKey
HRIJIYFUQJBWAF-UHFFFAOYSA-NSynonyms
2(((2oxo6(propan2yl)2Hchromen4yl)methyl)sulfanyl)4(trifluoromethyl)5678tetrahydroquinoline3carbonitrile
2((2oxo6propan2ylchromen4yl)methylsulfanyl)4(trifluoromethyl)5678tetrahydroquinoline3carbonitrile
CC(C)C1=CC2=C(C=C1)OC(=O)C=C2CSC3=NC4=C(CCCC4)C(=C3C#N)C(F)(F)F
InChI=1SC24H21F3N2O2Sc113(2)14782017(914)15(1021(30)3120)12322318(1128)22(24(2526)27)16534619(16)2923h71013H3612H212H3
MFCD10041355
ZINC000011865307
ZINC11865307
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