Vitas-M small molecule compound
7-tert-butyl-2-(butylsulfanyl)-3-(3-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK546868
SMILES CCCCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)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 C25H32N2OS2 MW 440.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N2OS2/c1-6-7-13-29-24-26-22-21(23(28)27(24)18-10-8-9-16(2)14-18)19-12-11-17(25(3,4)5)15-20(19)30-22/h8-10,14,17H,6-7,11-13,15H2,1-5H3InChIKey
PTPYUTFVMLPNQL-UHFFFAOYSA-NSynonyms
488814-03-5488814035
7(tertbutyl)2(butylthio)3(mtolyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
7tertbutyl2(butylsulfanyl)3(3methylphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
7tertbutyl2butylsulfanyl3(3methylphenyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCCCSC1=NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)N1C4=CC=CC(=C4)C
InChI=1SC25H32N2OS2c167132924262221(23(28)27(24)18108916(2)1418)19121117(25(34)5)1520(19)3022h8101417H67111315H215H3
MFCD03293726
ZINC000002360286
ZINC000002360288
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