Vitas-M small molecule compound
2-methoxy-4-{(Z)-[4-oxo-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl (2E)-3-(4-methoxyphenyl)prop-2-enoate
Catalog ID
STK702672
SMILES COc1cc(ccc1OC(=O)/C=C/c1ccc(cc1)OC)/C=C/1\SC(=S)N(C1=O)C(c1ccccc1)C
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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 C29H25NO5S2 MW 531.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25NO5S2/c1-19(22-7-5-4-6-8-22)30-28(32)26(37-29(30)36)18-21-11-15-24(25(17-21)34-3)35-27(31)16-12-20-9-13-23(33-2)14-10-20/h4-19H,1-3H3/b16-12+,26-18-InChIKey
ZYYYCYSZGQJVMG-BWWZDBMSSA-NSynonyms
(2METHOXY4((Z)(4OXO3(1PHENYLETHYL)2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)(E)3(4METHOXYPHENYL)PROP2ENOATE
(E)2methoxy4((Z)(4oxo3(1phenylethyl)2thioxothiazolidin5ylidene)methyl)phenyl3(4methoxyphenyl)acrylate
2methoxy4((Z)(4oxo3(1phenylethyl)2thioxo13thiazolidin5ylidene)methyl)phenyl(2E)3(4methoxyphenyl)prop2enoate
CC(C1=CC=CC=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OC(=O)C=CC4=CC=C(C=C4)OC)OC)SC2=S
COc1cc(ccc1OC(=O)C=Cc1ccc(cc1)OC)C=C1SC(=S)N(C1=O)C(c1ccccc1)C
InChI=1SC29H25NO5S2c119(227546822)3028(32)26(3729(30)36)1821111524(25(1721)343)3527(31)16122091323(332)141020h419H13H3b1612+2618
MFCD02988771
ZINC000100766961
ZINC000100766966
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