Vitas-M small molecule compound
methyl {2,4-dibromo-6-[(E)-{(2E)-2-[(3,4-dimethylphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl]phenoxy}acetate
Catalog ID
STK186578
SMILES COC(=O)COc1c(cc(cc1Br)Br)/C=C\1/S/C(=N/c2ccc(c(c2)C)C)/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 C21H18Br2N2O4S MW 554.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18Br2N2O4S/c1-11-4-5-15(6-12(11)2)24-21-25-20(27)17(30-21)8-13-7-14(22)9-16(23)19(13)29-10-18(26)28-3/h4-9H,10H2,1-3H3,(H,24,25,27)/b17-8+InChIKey
WGWSYPQIROWPCY-CAOOACKPSA-NSynonyms
CC1=C(C=C(C=C1)NC2=NC(=O)C(=CC3=CC(=CC(=C3OCC(=O)OC)Br)Br)S2)C
COC(=O)COc1c(cc(cc1Br)Br)C=C1SC(=Nc2ccc(c(c2)C)C)NC1=O
InChI=1SC21H18Br2N2O4Sc1114515(612(11)2)24212520(27)17(3021)813714(22)916(23)19(13)291018(26)283h49H10H213H3(H242527)b178+
METHYL(24DIBROMO6((E)((2E)2((34DIMETHYLPHENYL)IMINO)4OXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)ACETATE
methyl2(24dibromo6((E)(2(34dimethylanilino)4oxo13thiazol5ylidene)methyl)phenoxy)acetate
MFCD06664521
ZINC000097960802
ZINC97960802
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