Vitas-M small molecule compound
3-benzyl-7-tert-butyl-2-(hexylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK524739
SMILES CCCCCCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCC(C3)C(C)(C)C
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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 C27H36N2OS2 MW 468.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H36N2OS2/c1-5-6-7-11-16-31-26-28-24-23(25(30)29(26)18-19-12-9-8-10-13-19)21-15-14-20(27(2,3)4)17-22(21)32-24/h8-10,12-13,20H,5-7,11,14-18H2,1-4H3InChIKey
ZOKSZSODJMHGES-UHFFFAOYSA-NSynonyms
374094-79-8374094798
3benzyl7(tertbutyl)2(hexylthio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3benzyl7tertbutyl2(hexylsulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3benzyl7tertbutyl2hexylsulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCCCCCSC1=NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)N1CC4=CC=CC=C4
InChI=1SC27H36N2OS2c156711163126282423(25(30)29(26)18191298101319)21151420(27(23)4)1722(21)3224h810121320H57111418H214H3
MFCD01897813
ZINC000002283465
ZINC000002283466
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