Vitas-M small molecule compound

ethyl 4-({[1-(4-chlorophenyl)-5-oxo-3-(2-phenylethyl)-2-thioxoimidazolidin-4-yl]acetyl}amino)benzoate

Catalog ID
STK079266
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CC1N(CCc2ccccc2)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 C28H26ClN3O4S MW 536.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClN3O4S/c1-2-36-27(35)20-8-12-22(13-9-20)30-25(33)18-24-26(34)32(23-14-10-21(29)11-15-23)28(37)31(24)17-16-19-6-4-3-5-7-19/h3-15,24H,2,16-18H2,1H3,(H,30,33)
InChIKey
UBUUHDJUFIMESJ-UHFFFAOYSA-N
Synonyms
1024017-56-8
1024017568
CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCC3=CC=CC=C3)C4=CC=C(C=C4)Cl
CCOC(=O)c1ccc(cc1)NC(=O)CC1N(CCc2ccccc2)C(=S)N(C1=O)c1ccc(cc1)Cl
ETHYL4(((1(4CHLOROPHENYL)5OXO3(2PHENYLETHYL)2THIOXOIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
ethyl4((2(1(4chlorophenyl)5oxo3(2phenylethyl)2sulfanylideneimidazolidin4yl)acetyl)amino)benzoate
ETHYL4((2(1(4CHLOROPHENYL)5OXO3PHENETHYL2SULFANYLIDENEIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
ethyl4(2(1(4chlorophenyl)5oxo3phenethyl2thioxoimidazolidin4yl)acetamido)benzoate
InChI=1SC28H26ClN3O4Sc123627(35)2081222(13920)3025(33)182426(34)32(23141021(29)111523)28(37)31(24)1716196435719h31524H21618H21H3(H3033)
MFCD02142011
STK079266
ZINC000097952048
ZINC000097952049

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Available files

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