Vitas-M small molecule compound

methyl [(5Z)-3-(4-chlorophenyl)-5-(2,4-dichlorobenzylidene)-4-oxo-2-thioxoimidazolidin-1-yl]acetate

Catalog ID
STK036726
SMILES COC(=O)CN1/C(=C\c2ccc(cc2Cl)Cl)/C(=O)N(C1=S)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 C19H13Cl3N2O3S MW 455.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13Cl3N2O3S/c1-27-17(25)10-23-16(8-11-2-3-13(21)9-15(11)22)18(26)24(19(23)28)14-6-4-12(20)5-7-14/h2-9H,10H2,1H3/b16-8-
InChIKey
STWNHUYNHIRUFV-PXNMLYILSA-N
Synonyms

COC(=O)CN1C(=CC2=C(C=C(C=C2)Cl)Cl)C(=O)N(C1=S)C3=CC=C(C=C3)Cl
COC(=O)CN1C(=Cc2ccc(cc2Cl)Cl)C(=O)N(C1=S)c1ccc(cc1)Cl
InChI=1SC19H13Cl3N2O3Sc12717(25)102316(8112313(21)915(11)22)18(26)24(19(23)28)146412(20)5714h29H10H21H3b168
METHYL((5Z)3(4CHLOROPHENYL)5(24DICHLOROBENZYLIDENE)4OXO2THIOXOIMIDAZOLIDIN1YL)ACETATE
METHYL2((5Z)3(4CHLOROPHENYL)5((24DICHLOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENEIMIDAZOLIDIN1YL)ACETATE
MFCD04126462
STK036726
ZINC000009280145
ZINC09280145
ZINC9280145

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.