Vitas-M small molecule compound
4-(3-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-N-(prop-2-en-1-yl)piperazine-1-carbothioamide
Catalog ID
STK639089
SMILES C=CCNC(=S)N1CCN(CC1)c1nc2sc3c(c2c(=O)n1CCCC)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 C22H31N5OS2 MW 445.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H31N5OS2/c1-3-5-11-27-20(28)18-16-8-6-7-9-17(16)30-19(18)24-21(27)25-12-14-26(15-13-25)22(29)23-10-4-2/h4H,2-3,5-15H2,1H3,(H,23,29)InChIKey
JAPKNHIKDLRWLG-UHFFFAOYSA-NSynonyms
1010921-73-94(3butyl4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)N(prop2en1yl)piperazine1carbothioamide
4(3butyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)Nprop2enylpiperazine1carbothioamide
CCCCN1C(=O)C2=C(N=C1N3CCN(CC3)C(=S)NCC=C)SC4=C2CCCC4
Nallyl4(3butyl4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)piperazine1carbothioamide
Registry IDs
MFCD12200183ZINC000012322919
ZINC12322919
Check stock
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Check stock on Vitas-MAvailable files
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