Vitas-M small molecule compound
2-(3,4-diethoxybenzyl)-9-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL176834
SMILES CCOc1cc(ccc1OCC)Cc1nn2c(n1)c1c(nc2)sc2c1CCC(C2)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 C23H26N4O2S MW 422.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O2S/c1-4-28-17-9-7-15(11-18(17)29-5-2)12-20-25-22-21-16-8-6-14(3)10-19(16)30-23(21)24-13-27(22)26-20/h7,9,11,13-14H,4-6,8,10,12H2,1-3H3InChIKey
RZDSWEMPHKFALM-UHFFFAOYSA-NSynonyms
677313-14-32(34diethoxybenzyl)9methyl891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidine
677313143
CCOC1=C(C=C(C=C1)CC2=NN3C=NC4=C(C3=N2)C5=C(S4)CC(CC5)C)OCC
InChI=1SC23H26N4O2Sc1428179715(1118(17)2952)1220252221168614(3)1019(16)3023(21)241327(22)2620h79111314H4681012H213H3
MFCD04129887
ZINC000002790327
ZINC000002790328
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