Vitas-M small molecule compound
2-(pentylsulfanyl)-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK720762
SMILES CCCCCSc1nc2sc3c(c2c(=O)n1CC=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 C18H24N2OS2 MW 348.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N2OS2/c1-3-5-8-12-22-18-19-16-15(17(21)20(18)11-4-2)13-9-6-7-10-14(13)23-16/h4H,2-3,5-12H2,1H3InChIKey
KXRCOGMVIKUWSW-UHFFFAOYSA-NSynonyms
4594-43-82(pentylsulfanyl)3(prop2en1yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2pentylsulfanyl3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
3allyl2(pentylthio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
4594438
CCCCCSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1CC=C
InChI=1SC18H24N2OS2c1358122218191615(17(21)20(18)1142)139671014(13)2316h4H23512H21H3
MFCD01557427
ZINC000002361991
ZINC02361991
ZINC2361991
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