Vitas-M small molecule compound
2-(9-tert-butyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-1-ium-2-yl)naphthalen-1-olate
Catalog ID
STL049103
SMILES [O-]c1c2ccccc2ccc1c1nn2c([nH+]1)c1c(nc2)sc2c1CCC(C2)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 C25H24N4OS MW 428.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4OS/c1-25(2,3)15-9-11-17-19(12-15)31-24-20(17)23-27-22(28-29(23)13-26-24)18-10-8-14-6-4-5-7-16(14)21(18)30/h4-8,10,13,15,30H,9,11-12H2,1-3H3InChIKey
PGYDMCASXVERJN-UHFFFAOYSA-NSynonyms
850751-55-2(O)c1c2ccccc2ccc1c1nn2c((nH+)1)c1c(nc2)sc2c1CCC(C2)C(C)(C)C
2(9tertbutyl891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidin1ium2yl)naphthalen1olate
850751552
MFCD05694792
ZINC000001897313
ZINC000001897314
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