Vitas-M small molecule compound
2-methoxy-4-[(E)-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl (2E)-3-(4-methoxyphenyl)prop-2-enoate
Catalog ID
STK702574
SMILES COc1cc(ccc1OC(=O)/C=C/c1ccc(cc1)OC)/C=C\1/SC(=S)NC1=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 C21H17NO5S2 MW 427.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17NO5S2/c1-25-15-7-3-13(4-8-15)6-10-19(23)27-16-9-5-14(11-17(16)26-2)12-18-20(24)22-21(28)29-18/h3-12H,1-2H3,(H,22,24,28)/b10-6+,18-12+InChIKey
QMCRTGANCFLATF-PDDUZAPNSA-NSynonyms
(2METHOXY4((E)(4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)(E)3(4METHOXYPHENYL)PROP2ENOATE
(E)2methoxy4((Z)(4oxo2thioxothiazolidin5ylidene)methyl)phenyl3(4methoxyphenyl)acrylate
2methoxy4((E)(4oxo2thioxo13thiazolidin5ylidene)methyl)phenyl(2E)3(4methoxyphenyl)prop2enoate
COC1=CC=C(C=C1)C=CC(=O)OC2=C(C=C(C=C2)C=C3C(=O)NC(=S)S3)OC
COc1cc(ccc1OC(=O)C=Cc1ccc(cc1)OC)C=C1SC(=S)NC1=O
InChI=1SC21H17NO5S2c125157313(4815)61019(23)27169514(1117(16)262)121820(24)2221(28)2918h312H12H3(H222428)b106+1812+
MFCD03225726
ZINC000001245729
ZINC1245729
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