Vitas-M small molecule compound

2-{[N-(3,5-dimethylphenyl)-N-(methylsulfonyl)glycyl]amino}-N-(prop-2-en-1-yl)benzamide

Catalog ID
STK112516
SMILES C=CCNC(=O)c1ccccc1NC(=O)CN(S(=O)(=O)C)c1cc(C)cc(c1)C

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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 C21H25N3O4S MW 415.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O4S/c1-5-10-22-21(26)18-8-6-7-9-19(18)23-20(25)14-24(29(4,27)28)17-12-15(2)11-16(3)13-17/h5-9,11-13H,1,10,14H2,2-4H3,(H,22,26)(H,23,25)
InChIKey
OFWVPTFYKMXFND-UHFFFAOYSA-N
Synonyms

2((2(35DIMETHYLNMETHYLSULFONYLANILINO)ACETYL)AMINO)NPROP2ENYLBENZAMIDE
2((N(35DIMETHYLPHENYL)N(METHYLSULFONYL)GLYCYL)AMINO)N(PROP2EN1YL)BENZAMIDE
CC1=CC(=CC(=C1)N(CC(=O)NC2=CC=CC=C2C(=O)NCC=C)S(=O)(=O)C)C
InChI=1SC21H25N3O4Sc15102221(26)18867919(18)2320(25)1424(29(427)28)171215(2)1116(3)1317h591113H11014H224H3(H2226)(H2325)
MFCD03997337
ZINC000002837988
ZINC02837988
ZINC2837988

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Available files

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