Vitas-M small molecule compound
methyl (2-methoxy-4-{(Z)-[3-(4-methylbenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetate
Catalog ID
STL374998
SMILES COC(=O)COc1ccc(cc1OC)/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)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 C22H21NO5S2 MW 443.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO5S2/c1-14-4-6-15(7-5-14)12-23-21(25)19(30-22(23)29)11-16-8-9-17(18(10-16)26-2)28-13-20(24)27-3/h4-11H,12-13H2,1-3H3/b19-11-InChIKey
DDADVPCZCXIFLL-ODLFYWEKSA-NSynonyms
CC1=CC=C(C=C1)CN2C(=O)C(=CC3=CC(=C(C=C3)OCC(=O)OC)OC)SC2=S
COC(=O)COc1ccc(cc1OC)C=C1SC(=S)N(C1=O)Cc1ccc(cc1)C
InChI=1SC22H21NO5S2c1144615(7514)122321(25)19(3022(23)29)11168917(18(1016)262)281320(24)273h411H1213H213H3b1911
methyl(2methoxy4((Z)(3(4methylbenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)phenoxy)acetate
METHYL2(2METHOXY4((Z)(3((4METHYLPHENYL)METHYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)ACETATE
MFCD03721712
ZINC000002830617
ZINC02830617
ZINC2830617
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