Vitas-M small molecule compound

4-{3-[(E)-(2-{[4-(acetylamino)phenyl]carbonyl}hydrazinylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoic acid

Catalog ID
STL417503
SMILES CC(=O)Nc1ccc(cc1)C(=O)N/N=C/c1cc(n(c1C)c1ccc(cc1)C(=O)O)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 C23H22N4O4 MW 418.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O4/c1-14-12-19(15(2)27(14)21-10-6-18(7-11-21)23(30)31)13-24-26-22(29)17-4-8-20(9-5-17)25-16(3)28/h4-13H,1-3H3,(H,25,28)(H,26,29)(H,30,31)/b24-13+
InChIKey
DKFSOKQEWUWMAS-ZMOGYAJESA-N
Synonyms

4(3((E)((4acetamidobenzoyl)hydrazinylidene)methyl)25dimethylpyrrol1yl)benzoicacid
4(3((E)(2((4(acetylamino)phenyl)carbonyl)hydrazinylidene)methyl)25dimethyl1Hpyrrol1yl)benzoicacid
CC(=O)Nc1ccc(cc1)C(=O)NN=Cc1cc(n(c1C)c1ccc(cc1)C(=O)O)C
CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)O)C)C=NNC(=O)C3=CC=C(C=C3)NC(=O)C
InChI=1SC23H22N4O4c1141219(15(2)27(14)2110618(71121)23(30)31)13242622(29)174820(9517)2516(3)28h413H13H3(H2528)(H2629)(H3031)b2413+
MFCD05813363
ZINC000006044014
ZINC97995886

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Available files

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