Vitas-M small molecule compound
2-(heptylsulfanyl)-3-(3-methylphenyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK540795
SMILES CCCCCCCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)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/c1-3-4-5-6-7-14-27-23-24-21-20(18-12-9-13-19(18)28-21)22(26)25(23)17-11-8-10-16(2)15-17/h8,10-11,15H,3-7,9,12-14H2,1-2H3InChIKey
UETVTJGSXDXJIR-UHFFFAOYSA-NSynonyms
385391-92-42(heptylsulfanyl)3(3methylphenyl)3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin4one
2(heptylthio)3(mtolyl)67dihydro3Hcyclopenta(45)thieno(23d)pyrimidin4(5H)one
385391924
3heptylsulfanyl2(3methylphenyl)78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin1one
CCCCCCCSC1=NC2=C(C3=C(S2)CCC3)C(=O)N1C4=CC=CC(=C4)C
InChI=1SC23H28N2OS2c134567142723242120(181291319(18)2821)22(26)25(23)171181016(2)1517h8101115H3791214H212H3
MFCD03285758
ZINC000002320215
ZINC2320215
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