Vitas-M small molecule compound
4-(4-bromophenyl)-2-oxo-1,3-benzoxathiol-5-yl 3-[(5E)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoate
Catalog ID
STK534824
SMILES O=C(Oc1ccc2c(c1c1ccc(cc1)Br)sc(=O)o2)CCN1C(=S)S/C(=C/c2ccccc2)/C1=O
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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 C26H16BrNO5S3 MW 598.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H16BrNO5S3/c27-17-8-6-16(7-9-17)22-18(10-11-19-23(22)36-26(31)33-19)32-21(29)12-13-28-24(30)20(35-25(28)34)14-15-4-2-1-3-5-15/h1-11,14H,12-13H2/b20-14+InChIKey
NRZYNTCQTBCNAZ-XSFVSMFZSA-NSynonyms
(4(4BROMOPHENYL)2OXO13BENZOXATHIOL5YL)3((5E)5BENZYLIDENE4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOATE
(E)4(4bromophenyl)2oxobenzo(d)(13)oxathiol5yl3(5benzylidene4oxo2thioxothiazolidin3yl)propanoate
4(4bromophenyl)2oxo13benzoxathiol5yl3((5E)5benzylidene4oxo2thioxo13thiazolidin3yl)propanoate
C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)OC3=C(C4=C(C=C3)OC(=O)S4)C5=CC=C(C=C5)Br
InChI=1SC26H16BrNO5S3c27178616(7917)2218(10111923(22)3626(31)3319)3221(29)12132824(30)20(3525(28)34)14154213515h11114H1213H2b2014+
MFCD02989545
O=C(Oc1ccc2c(c1c1ccc(cc1)Br)sc(=O)o2)CCN1C(=S)SC(=Cc2ccccc2)C1=O
ZINC000001838987
ZINC01838987
ZINC1838987
Check stock
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