Vitas-M small molecule compound
4-[(E)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-methylbenzoate
Catalog ID
STK809199
SMILES CCCCN1C(=S)S/C(=C/c2ccc(c(c2)OC)OC(=O)c2ccc(cc2)C)/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 C23H23NO4S2 MW 441.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO4S2/c1-4-5-12-24-21(25)20(30-23(24)29)14-16-8-11-18(19(13-16)27-3)28-22(26)17-9-6-15(2)7-10-17/h6-11,13-14H,4-5,12H2,1-3H3/b20-14+InChIKey
QQBZAVSGYVQTRF-XSFVSMFZSA-NSynonyms
(4((E)(3BUTYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)2METHOXYPHENYL)4METHYLBENZOATE
4((E)(3butyl4oxo2thioxo13thiazolidin5ylidene)methyl)2methoxyphenyl4methylbenzoate
CCCCN1C(=O)C(=CC2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)C)OC)SC1=S
CCCCN1C(=S)SC(=Cc2ccc(c(c2)OC)OC(=O)c2ccc(cc2)C)C1=O
InChI=1SC23H23NO4S2c145122421(25)20(3023(24)29)141681118(19(1316)273)2822(26)179615(2)71017h6111314H4512H213H3b2014+
MFCD03461258
ZINC000016790616
ZINC16790616
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