Vitas-M small molecule compound
methyl (2-{(Z)-[1-(4-chlorophenyl)-3-methyl-5-oxo-2-thioxoimidazolidin-4-ylidene]methyl}phenoxy)acetate
Catalog ID
STL378795
SMILES COC(=O)COc1ccccc1/C=C/1\N(C)C(=S)N(C1=O)c1ccc(cc1)Cl
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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 C20H17ClN2O4S MW 416.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN2O4S/c1-22-16(11-13-5-3-4-6-17(13)27-12-18(24)26-2)19(25)23(20(22)28)15-9-7-14(21)8-10-15/h3-11H,12H2,1-2H3/b16-11-InChIKey
XFYCYJHAVKHZFE-WJDWOHSUSA-NSynonyms
CN1C(=CC2=CC=CC=C2OCC(=O)OC)C(=O)N(C1=S)C3=CC=C(C=C3)Cl
COC(=O)COc1ccccc1C=C1N(C)C(=S)N(C1=O)c1ccc(cc1)Cl
InChI=1SC20H17ClN2O4Sc12216(1113534617(13)271218(24)262)19(25)23(20(22)28)159714(21)81015h311H12H212H3b1611
methyl(2((Z)(1(4chlorophenyl)3methyl5oxo2thioxoimidazolidin4ylidene)methyl)phenoxy)acetate
METHYL2(2((Z)(1(4CHLOROPHENYL)3METHYL5OXO2SULFANYLIDENEIMIDAZOLIDIN4YLIDENE)METHYL)PHENOXY)ACETATE
MFCD03699445
ZINC000004498501
ZINC04498501
ZINC4498501
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