Vitas-M small molecule compound
2-[4-(methylsulfanyl)phenyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK712002
SMILES CSc1ccc(cc1)c1nc2sc3c(c2c(=O)[nH]1)CCCC3
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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 C17H16N2OS2 MW 328.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2OS2/c1-21-11-8-6-10(7-9-11)15-18-16(20)14-12-4-2-3-5-13(12)22-17(14)19-15/h6-9H,2-5H2,1H3,(H,18,19,20)InChIKey
VQBRXXZGWAGVHY-UHFFFAOYSA-NSynonyms
2(4(methylsulfanyl)phenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(4(methylthio)phenyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2(4methylsulfanylphenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
CSC1=CC=C(C=C1)C2=NC3=C(C4=C(S3)CCCC4)C(=O)N2
CSc1ccc(cc1)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC17H16N2OS2c121118610(7911)151816(20)1412423513(12)2217(14)1915h69H25H21H3(H181920)
MFCD01836142
ZINC000009667335
ZINC09667335
ZINC9667335
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