Vitas-M small molecule compound

methyl [3-(4-fluorophenyl)-5-{2-[(4-methoxyphenyl)amino]-2-oxoethyl}-4-oxo-2-thioxoimidazolidin-1-yl]acetate

Catalog ID
STK142464
SMILES COC(=O)CN1C(CC(=O)Nc2ccc(cc2)OC)C(=O)N(C1=S)c1ccc(cc1)F

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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 C21H20FN3O5S MW 445.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FN3O5S/c1-29-16-9-5-14(6-10-16)23-18(26)11-17-20(28)25(15-7-3-13(22)4-8-15)21(31)24(17)12-19(27)30-2/h3-10,17H,11-12H2,1-2H3,(H,23,26)
InChIKey
XPWUYJILDDUVCB-UHFFFAOYSA-N
Synonyms
1031764-96-1
(3(4FLUOROPHENYL)5((4METHOXYPHENYLCARBAMOYL)METHYL)4OXO2THIOXOIMIDAZOLIDIN1YL)ACETICACIDMETHYLESTER
1031764961
COC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CC(=O)OC)C3=CC=C(C=C3)F
InChI=1SC21H20FN3O5Sc129169514(61016)2318(26)111720(28)25(157313(22)4815)21(31)24(17)1219(27)302h31017H1112H212H3(H2326)
METHYL(3(4FLUOROPHENYL)5(2((4METHOXYPHENYL)AMINO)2OXOETHYL)4OXO2THIOXOIMIDAZOLIDIN1YL)ACETATE
methyl2(3(4fluorophenyl)5(2((4methoxyphenyl)amino)2oxoethyl)4oxo2thioxoimidazolidin1yl)acetate
METHYL2(3(4FLUOROPHENYL)5(2(4METHOXYANILINO)2OXOETHYL)4OXO2SULFANYLIDENEIMIDAZOLIDIN1YL)ACETATE
MFCD03056783
ZINC000002409999
ZINC000002410000

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Available files

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