Vitas-M small molecule compound
7-(4-bromophenyl)-2-oxo-1,3-benzoxathiol-5-yl 3-[(5Z)-5-(4-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoate
Catalog ID
STK823231
SMILES O=C(Oc1cc2sc(=O)oc2c(c1)c1ccc(cc1)Br)CCN1C(=S)S/C(=C\c2ccc(cc2)Cl)/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 C26H15BrClNO5S3 MW 632.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H15BrClNO5S3/c27-16-5-3-15(4-6-16)19-12-18(13-20-23(19)34-26(32)37-20)33-22(30)9-10-29-24(31)21(36-25(29)35)11-14-1-7-17(28)8-2-14/h1-8,11-13H,9-10H2/b21-11-InChIKey
TZPIEOUDCPNNJL-NHDPSOOVSA-NSynonyms
(7(4bromophenyl)2oxo13benzoxathiol5yl)3((5Z)5((4chlorophenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)propanoate
7(4bromophenyl)2oxo13benzoxathiol5yl3((5Z)5(4chlorobenzylidene)4oxo2thioxo13thiazolidin3yl)propanoate
C1=CC(=CC=C1C=C2C(=O)N(C(=S)S2)CCC(=O)OC3=CC4=C(C(=C3)C5=CC=C(C=C5)Br)OC(=O)S4)Cl
InChI=1SC26H15BrClNO5S3c27165315(4616)191218(132023(19)3426(32)3720)3322(30)9102924(31)21(3625(29)35)11141717(28)8214h181113H910H2b2111
MFCD03463776
O=C(Oc1cc2sc(=O)oc2c(c1)c1ccc(cc1)Br)CCN1C(=S)SC(=Cc2ccc(cc2)Cl)C1=O
ZINC000097947148
ZINC97947148
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