Vitas-M small molecule compound
3-({(2E)-3-[5-(benzyloxy)-1H-indol-3-yl]-2-cyanoprop-2-enoyl}amino)benzoic acid
Catalog ID
STL382985
SMILES N#C/C(=C\c1c[nH]c2c1cc(OCc1ccccc1)cc2)/C(=O)Nc1cccc(c1)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 C26H19N3O4 MW 437.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N3O4/c27-14-19(25(30)29-21-8-4-7-18(12-21)26(31)32)11-20-15-28-24-10-9-22(13-23(20)24)33-16-17-5-2-1-3-6-17/h1-13,15,28H,16H2,(H,29,30)(H,31,32)/b19-11+InChIKey
NPEHQUHWGPVTGK-YBFXNURJSA-NSynonyms
634594-80-23(((2E)3(5(benzyloxy)1Hindol3yl)2cyanoprop2enoyl)amino)benzoicacid
3(((E)2CYANO3(5PHENYLMETHOXY1HINDOL3YL)PROP2ENOYL)AMINO)BENZOICACID
634594802
C1=CC=C(C=C1)COC2=CC3=C(C=C2)NC=C3C=C(C#N)C(=O)NC4=CC=CC(=C4)C(=O)O
InChI=1SC26H19N3O4c271419(25(30)292184718(1221)26(31)32)112015282410922(1323(20)24)3316175213617h1131528H16H2(H2930)(H3132)b1911+
MFCD03217412
N#CC(=Cc1c(nH)c2c1cc(OCc1ccccc1)cc2)C(=O)Nc1cccc(c1)C(=O)O
ZINC000002784810
ZINC2784810
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