Vitas-M small molecule compound
2-(hexylsulfanyl)-3-(2-methylphenyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK532181
SMILES CCCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1C)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 C22H26N2OS2 MW 398.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2OS2/c1-3-4-5-8-14-26-22-23-20-19(16-11-9-13-18(16)27-20)21(25)24(22)17-12-7-6-10-15(17)2/h6-7,10,12H,3-5,8-9,11,13-14H2,1-2H3InChIKey
KIVOJTUGBPSSBX-UHFFFAOYSA-NSynonyms
2(hexylsulfanyl)3(2methylphenyl)3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin4one
2(hexylthio)3(otolyl)67dihydro3Hcyclopenta(45)thieno(23d)pyrimidin4(5H)one
3hexylsulfanyl2(2methylphenyl)78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin1one
CCCCCCSC1=NC2=C(C3=C(S2)CCC3)C(=O)N1C4=CC=CC=C4C
InChI=1SC22H26N2OS2c13458142622232019(161191318(16)2720)21(25)24(22)1712761015(17)2h671012H3589111314H212H3
MFCD02987354
ZINC000001818759
ZINC01818759
ZINC1818759
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