Vitas-M small molecule compound

1-(4-methylpiperidin-1-yl)-2-[(13-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
STL226914
SMILES CC1CCN(CC1)C(=O)CSc1nnc2n1c1sc3c(c1c1n2ncn1)C(C)CCC3

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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/c1-12-6-8-26(9-7-12)15(29)10-30-21-25-24-20-27(21)19-17(18-22-11-23-28(18)20)16-13(2)4-3-5-14(16)31-19/h11-13H,3-10H2,1-2H3
InChIKey
MALVXHZHCXJFCZ-UHFFFAOYSA-N
Synonyms
861118-72-1
1(4methylpiperidin1yl)2((13methyl10111213tetrahydro(1)benzothieno(32e)bis(124)triazolo(43a15c)pyrimidin7yl)sulfanyl)ethanone
2((13methyl10111213tetrahydrobenzo(45)thieno(32e)bis((124)triazolo)(43a15c)pyrimidin7yl)thio)1(4methylpiperidin1yl)ethanone
861118721
CC1CCN(CC1)C(=O)CSC2=NN=C3N2C4=C(C5=C(S4)CCCC5C)C6=NC=NN63
InChI=1SC21H25N7OS2c1126826(9712)15(29)10302125242027(21)1917(1822112328(18)20)1613(2)43514(16)3119h1113H310H212H3
MFCD05683168
ZINC000009307629
ZINC000009307630

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Available files

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