Vitas-M small molecule compound
2-(heptylsulfanyl)-3-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK720919
SMILES CCCCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCCC3
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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 C24H30N2OS2 MW 426.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N2OS2/c1-2-3-4-5-12-17-28-24-25-22-21(19-15-10-7-11-16-20(19)29-22)23(27)26(24)18-13-8-6-9-14-18/h6,8-9,13-14H,2-5,7,10-12,15-17H2,1H3InChIKey
WDDNOCIFYYEXFM-UHFFFAOYSA-NSynonyms
351160-03-72(heptylsulfanyl)3phenyl356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
2(heptylthio)3phenyl6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
2heptylsulfanyl3phenyl6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
351160037
CCCCCCCSC1=NC2=C(C3=C(S2)CCCCC3)C(=O)N1C4=CC=CC=C4
InChI=1SC24H30N2OS2c1234512172824252221(1915107111620(19)2922)23(27)26(24)18138691418h6891314H25710121517H21H3
MFCD01877733
ZINC000002272785
ZINC2272785
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