Vitas-M small molecule compound

7-methyl-2-(methylsulfanyl)-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

Catalog ID
STK532659
SMILES CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCC(C3)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 C18H18N2OS2 MW 342.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2OS2/c1-11-8-9-13-14(10-11)23-16-15(13)17(21)20(18(19-16)22-2)12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3
InChIKey
MFGACVUQAVSPNQ-UHFFFAOYSA-N
Synonyms

7methyl2(methylsulfanyl)3phenyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
7methyl2(methylthio)3phenyl5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
7methyl2methylsulfanyl3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SC)C4=CC=CC=C4
InChI=1SC18H18N2OS2c111891314(1011)231615(13)17(21)20(18(1916)222)126435712h3711H810H212H3
MFCD02236052
ZINC000000154657
ZINC000002614190

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.