Vitas-M small molecule compound
9-tert-butyl-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK945149
SMILES Cc1ccc(c(c1)OCc1nn2c(n1)c1c(nc2)sc2c1CCC(C2)C(C)(C)C)C(C)C
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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 C26H32N4OS MW 448.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N4OS/c1-15(2)18-9-7-16(3)11-20(18)31-13-22-28-24-23-19-10-8-17(26(4,5)6)12-21(19)32-25(23)27-14-30(24)29-22/h7,9,11,14-15,17H,8,10,12-13H2,1-6H3InChIKey
OMLOYOOBNNKRIT-UHFFFAOYSA-NSynonyms
850732-19-3850732193
9(tertbutyl)2((2isopropyl5methylphenoxy)methyl)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(15c)pyrimidine
9tertbutyl2((5methyl2(propan2yl)phenoxy)methyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidine
CC1=CC(=C(C=C1)C(C)C)OCC2=NN3C=NC4=C(C3=N2)C5=C(S4)CC(CC5)C(C)(C)C
InChI=1SC26H32N4OSc115(2)189716(3)1120(18)3113222824231910817(26(45)6)1221(19)3225(23)271430(24)2922h7911141517H8101213H216H3
MFCD05693138
ZINC000002402307
ZINC000002402308
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