Vitas-M small molecule compound
5-methyl-3-(4-methylphenyl)-2-(pentylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK532143
SMILES CCCCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)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 C23H28N2OS2 MW 412.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2OS2/c1-4-5-6-14-27-23-24-21-20(19-16(3)8-7-9-18(19)28-21)22(26)25(23)17-12-10-15(2)11-13-17/h10-13,16H,4-9,14H2,1-3H3InChIKey
PTDHEJPQSPVPAJ-UHFFFAOYSA-NSynonyms
5methyl2(pentylthio)3(ptolyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
5methyl3(4methylphenyl)2(pentylsulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
5methyl3(4methylphenyl)2pentylsulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCCCCSC1=NC2=C(C3=C(S2)CCCC3C)C(=O)N1C4=CC=C(C=C4)C
InChI=1SC23H28N2OS2c1456142723242120(1916(3)87918(19)2821)22(26)25(23)17121015(2)111317h101316H4914H213H3
MFCD02985298
ZINC000001784627
ZINC000001784629
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