Vitas-M small molecule compound
2-(butylsulfanyl)-5-methyl-3-(4-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK722288
SMILES CCCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)C(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 C22H26N2OS2 MW 398.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2OS2/c1-4-5-13-26-22-23-20-19(18-15(3)7-6-8-17(18)27-20)21(25)24(22)16-11-9-14(2)10-12-16/h9-12,15H,4-8,13H2,1-3H3InChIKey
GOORXGCVGMBSIH-UHFFFAOYSA-NSynonyms
2(butylsulfanyl)5methyl3(4methylphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(butylthio)5methyl3(ptolyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2butylsulfanyl5methyl3(4methylphenyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCCCSC1=NC2=C(C3=C(S2)CCCC3C)C(=O)N1C4=CC=C(C=C4)C
InChI=1SC22H26N2OS2c145132622232019(1815(3)76817(18)2720)21(25)24(22)1611914(2)101216h91215H4813H213H3
MFCD02986053
ZINC000001895333
ZINC000001895334
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