Vitas-M small molecule compound
6-tert-butyl-2-{[(3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)methyl]sulfanyl}-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazoline
Catalog ID
STK769583
SMILES CC1(C)N=C(CSc2nc3CCC(Cc3c(n2)C(F)(F)F)C(C)(C)C)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 C25H30F3N3S MW 461.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30F3N3S/c1-23(2,3)16-10-11-19-18(12-16)21(25(26,27)28)30-22(29-19)32-14-20-17-9-7-6-8-15(17)13-24(4,5)31-20/h6-9,16H,10-14H2,1-5H3InChIKey
NXJCNJIFUFTABE-UHFFFAOYSA-NSynonyms
6tertbutyl2(((33dimethyl34dihydroisoquinolin1yl)methyl)sulfanyl)4(trifluoromethyl)5678tetrahydroquinazoline
6tertbutyl2((33dimethyl4Hisoquinolin1yl)methylsulfanyl)4(trifluoromethyl)5678tetrahydroquinazoline
CC1(CC2=CC=CC=C2C(=N1)CSC3=NC4=C(CC(CC4)C(C)(C)C)C(=N3)C(F)(F)F)C
InChI=1SC25H30F3N3Sc123(23)1610111918(1216)21(25(2627)28)3022(2919)32142017976815(17)1324(45)3120h6916H1014H215H3
MFCD03409363
ZINC000004442136
ZINC000008868030
Check stock
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Check stock on Vitas-MAvailable files
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