Vitas-M small molecule compound
2,2'-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4-diyldisulfanediyl)bis[1-(4-chlorophenyl)ethanone]
Catalog ID
STK698926
SMILES Clc1ccc(cc1)C(=O)CSc1nc(SCC(=O)c2ccc(cc2)Cl)c2c(n1)sc1c2CCCC1
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We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C26H20Cl2N2O2S3 MW 559.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20Cl2N2O2S3/c27-17-9-5-15(6-10-17)20(31)13-33-24-23-19-3-1-2-4-22(19)35-25(23)30-26(29-24)34-14-21(32)16-7-11-18(28)12-8-16/h5-12H,1-4,13-14H2InChIKey
FUBRUHHVTKNGBY-UHFFFAOYSA-NSynonyms
1(4chlorophenyl)2((2(2(4chlorophenyl)2oxoethyl)sulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4yl)sulfanyl)ethanone
22((5678tetrahydrobenzo(45)thieno(23d)pyrimidine24diyl)bis(sulfanediyl))bis(1(4chlorophenyl)ethanone)
22(5678tetrahydro(1)benzothieno(23d)pyrimidine24diyldisulfanediyl)bis(1(4chlorophenyl)ethanone)
C1CCC2=C(C1)C3=C(S2)N=C(N=C3SCC(=O)C4=CC=C(C=C4)Cl)SCC(=O)C5=CC=C(C=C5)Cl
InChI=1SC26H20Cl2N2O2S3c27179515(61017)20(31)1333242319312422(19)3525(23)3026(2924)341421(32)1671118(28)12816h512H141314H2
MFCD01854919
ZINC000001874718
ZINC01874718
ZINC1874718
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