Vitas-M small molecule compound
3-benzyl-2-(butylsulfanyl)-6-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK035331
SMILES CCCCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(CC3)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 C22H26N2OS2 MW 398.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2OS2/c1-3-4-12-26-22-23-20-19(17-13-15(2)10-11-18(17)27-20)21(25)24(22)14-16-8-6-5-7-9-16/h5-9,15H,3-4,10-14H2,1-2H3InChIKey
MHMBXVRCPCBGOL-UHFFFAOYSA-NSynonyms
369605-77-6369605776
3benzyl2(butylsulfanyl)6methyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3benzyl2(butylthio)6methyl5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3benzyl2butylsulfanyl6methyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCCCSC1=NC2=C(C3=C(S2)CCC(C3)C)C(=O)N1CC4=CC=CC=C4
CCCCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(CC3)C
InChI=1SC22H26N2OS2c134122622232019(171315(2)101118(17)2720)21(25)24(22)14168657916h5915H341014H212H3
MFCD01448757
STK035331
ZINC000002258966
ZINC000002258967
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