Vitas-M small molecule compound
3-(2-{(1E)-2-cyano-3-[(2-ethylphenyl)amino]-3-oxoprop-1-en-1-yl}-1H-pyrrol-1-yl)benzoic acid
Catalog ID
STK051499
SMILES N#C/C(=C\c1cccn1c1cccc(c1)C(=O)O)/C(=O)Nc1ccccc1CC
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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 C23H19N3O3 MW 385.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O3/c1-2-16-7-3-4-11-21(16)25-22(27)18(15-24)14-20-10-6-12-26(20)19-9-5-8-17(13-19)23(28)29/h3-14H,2H2,1H3,(H,25,27)(H,28,29)/b18-14+InChIKey
JVQFBHKFOHUOAG-NBVRZTHBSA-NSynonyms
3(2((1E)2CYANO3((2ETHYLPHENYL)AMINO)3OXOPROP1EN1YL)1HPYRROL1YL)BENZOICACID
3(2((E)2CYANO3(2ETHYLANILINO)3OXOPROP1ENYL)PYRROL1YL)BENZOICACID
CCC1=CC=CC=C1NC(=O)C(=CC2=CC=CN2C3=CC=CC(=C3)C(=O)O)C#N
InChI=1SC23H19N3O3c12167341121(16)2522(27)18(1524)14201061226(20)1995817(1319)23(28)29h314H2H21H3(H2527)(H2829)b1814+
MFCD03923563
N#CC(=Cc1cccn1c1cccc(c1)C(=O)O)C(=O)Nc1ccccc1CC
STK051499
ZINC000009262918
ZINC9262918
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