Vitas-M small molecule compound
3-(4-methylphenyl)-2-(propylsulfanyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK831020
SMILES CCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)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 C21H24N2OS2 MW 384.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2OS2/c1-3-13-25-21-22-19-18(16-7-5-4-6-8-17(16)26-19)20(24)23(21)15-11-9-14(2)10-12-15/h9-12H,3-8,13H2,1-2H3InChIKey
MSIAVPZGJAYYHH-UHFFFAOYSA-NSynonyms
351161-57-42(propylthio)3(ptolyl)6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
3(4methylphenyl)2(propylsulfanyl)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3(4methylphenyl)2propylsulfanyl6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
351161574
CCCSC1=NC2=C(C3=C(S2)CCCCC3)C(=O)N1C4=CC=C(C=C4)C
InChI=1SC21H24N2OS2c13132521221918(167546817(16)2619)20(24)23(21)1511914(2)101215h912H3813H212H3
MFCD01877756
ZINC000002272805
ZINC02272805
ZINC2272805
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