Vitas-M small molecule compound
4-(3-{(E)-[(benzyloxy)imino]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)-3-methylbenzoic acid
Catalog ID
STK195745
SMILES Cc1cc(ccc1n1c(C)cc(c1C)/C=N/OCc1ccccc1)C(=O)O
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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 C22H22N2O3 MW 362.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O3/c1-15-11-19(22(25)26)9-10-21(15)24-16(2)12-20(17(24)3)13-23-27-14-18-7-5-4-6-8-18/h4-13H,14H2,1-3H3,(H,25,26)/b23-13+InChIKey
ROVMLFKHAZDBHC-YDZHTSKRSA-NSynonyms
4(25dimethyl3((E)phenylmethoxyiminomethyl)pyrrol1yl)3methylbenzoicacid
4(3((E)((BENZYLOXY)IMINO)METHYL)25DIMETHYL1HPYRROL1YL)3METHYLBENZOICACID
CC1=CC(=C(N1C2=C(C=C(C=C2)C(=O)O)C)C)C=NOCC3=CC=CC=C3
Cc1cc(ccc1n1c(C)cc(c1C)C=NOCc1ccccc1)C(=O)O
InChI=1SC22H22N2O3c1151119(22(25)26)91021(15)2416(2)1220(17(24)3)13232714187546818h413H14H213H3(H2526)b2313+
MFCD04369772
ZINC000004712307
ZINC15228793
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