Vitas-M small molecule compound
1-(4-methylpiperidin-1-yl)-2-[(2-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]ethanone
Catalog ID
STL303867
SMILES CC1CCN(CC1)C(=O)CSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)CCCC3
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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 C21H25N7OS2 MW 455.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N7OS2/c1-12-7-9-26(10-8-12)16(29)11-30-21-24-23-20-27(21)19-17(18-22-13(2)25-28(18)20)14-5-3-4-6-15(14)31-19/h12H,3-11H2,1-2H3InChIKey
HARKKGDAHSRFMW-UHFFFAOYSA-NSynonyms
848986-40-31(4methylpiperidin1yl)2((2methyl10111213tetrahydro(1)benzothieno(32e)bis(124)triazolo(43a15c)pyrimidin7yl)sulfanyl)ethanone
2((2methyl10111213tetrahydrobenzo(45)thieno(32e)bis((124)triazolo)(43a15c)pyrimidin7yl)thio)1(4methylpiperidin1yl)ethanone
848986403
CC1CCN(CC1)C(=O)CSC2=NN=C3N2C4=C(C5=C(S4)CCCC5)C6=NC(=NN63)C
InChI=1SC21H25N7OS2c1127926(10812)16(29)11302124232027(21)1917(182213(2)2528(18)20)14534615(14)3119h12H311H212H3
MFCD05678473
ZINC000002445945
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