Vitas-M small molecule compound
1-({[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-3,3-dimethyl-3,4-dihydroisoquinoline
Catalog ID
STK769600
SMILES CC1(C)N=C(CSc2nc(cc(n2)C(F)(F)F)c2ccco2)c2c(C1)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 C21H18F3N3OS MW 417.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18F3N3OS/c1-20(2)11-13-6-3-4-7-14(13)16(27-20)12-29-19-25-15(17-8-5-9-28-17)10-18(26-19)21(22,23)24/h3-10H,11-12H2,1-2H3InChIKey
HTVZDJPHXLEEIO-UHFFFAOYSA-NSynonyms
1(((4(furan2yl)6(trifluoromethyl)pyrimidin2yl)sulfanyl)methyl)33dimethyl34dihydroisoquinoline
1((4(furan2yl)6(trifluoromethyl)pyrimidin2yl)sulfanylmethyl)33dimethyl4Hisoquinoline
2((33DIMETHYL(34DIHYDROISOQUINOLYL))METHYLTHIO)4(2FURYL)6(TRIFLUOROMETHYL)PYRIMIDINE
CC1(CC2=CC=CC=C2C(=N1)CSC3=NC(=CC(=N3)C(F)(F)F)C4=CC=CO4)C
InChI=1SC21H18F3N3OSc120(2)1113634714(13)16(2720)1229192515(178592817)1018(2619)21(2223)24h310H1112H212H3
MFCD03409393
ZINC000000974341
ZINC00974341
ZINC974341
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