Vitas-M small molecule compound
2-{[(2E)-3-(3-bromophenyl)-2-cyanoprop-2-enoyl]amino}benzoic acid
Catalog ID
STK083145
SMILES N#C/C(=C\c1cccc(c1)Br)/C(=O)Nc1ccccc1C(=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 C17H11BrN2O3 MW 371.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11BrN2O3/c18-13-5-3-4-11(9-13)8-12(10-19)16(21)20-15-7-2-1-6-14(15)17(22)23/h1-9H,(H,20,21)(H,22,23)/b12-8+InChIKey
YWXJWMKMISXVKQ-XYOKQWHBSA-NSynonyms
364602-72-22(((2E)3(3BROMOPHENYL)2CYANOPROP2ENOYL)AMINO)BENZOICACID
2(((E)3(3BROMOPHENYL)2CYANOPROP2ENOYL)AMINO)BENZOICACID
364602722
C1=CC=C(C(=C1)C(=O)O)NC(=O)C(=CC2=CC(=CC=C2)Br)C#N
InChI=1SC17H11BrN2O3c181353411(913)812(1019)16(21)2015721614(15)17(22)23h19H(H2021)(H2223)b128+
MFCD02608441
N#CC(=Cc1cccc(c1)Br)C(=O)Nc1ccccc1C(=O)O
STK083145
ZINC000002774007
ZINC2774007
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