Vitas-M small molecule compound

N-(3-benzyl-5-{2-[(4-methoxyphenyl)amino]-2-oxoethyl}-4-oxo-2-thioxoimidazolidin-1-yl)-3-fluorobenzamide

Catalog ID
STK028538
SMILES COc1ccc(cc1)NC(=O)CC1C(=O)N(C(=S)N1NC(=O)c1cccc(c1)F)Cc1ccccc1

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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 C26H23FN4O4S MW 506.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23FN4O4S/c1-35-21-12-10-20(11-13-21)28-23(32)15-22-25(34)30(16-17-6-3-2-4-7-17)26(36)31(22)29-24(33)18-8-5-9-19(27)14-18/h2-14,22H,15-16H2,1H3,(H,28,32)(H,29,33)
InChIKey
IBRQSQHZMJYWDR-UHFFFAOYSA-N
Synonyms
956182-50-6
956182506
COC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2NC(=O)C3=CC(=CC=C3)F)CC4=CC=CC=C4
COc1ccc(cc1)NC(=O)CC1C(=O)N(C(=S)N1NC(=O)c1cccc(c1)F)Cc1ccccc1
InChI=1SC26H23FN4O4Sc13521121020(111321)2823(32)152225(34)30(16176324717)26(36)31(22)2924(33)1885919(27)1418h21422H1516H21H3(H2832)(H2933)
MFCD02143514
N(3BENZYL5(2((4METHOXYPHENYL)AMINO)2OXOETHYL)4OXO2THIOXOIMIDAZOLIDIN1YL)3FLUOROBENZAMIDE
N(3BENZYL5(2(4METHOXYANILINO)2OXOETHYL)4OXO2SULFANYLIDENEIMIDAZOLIDIN1YL)3FLUOROBENZAMIDE
STK028538
ZINC000000720156
ZINC000000720157

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Available files

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