Vitas-M small molecule compound
(2E)-4-oxo-4-{[2-(phenylethynyl)phenyl]amino}but-2-enoic acid
Catalog ID
STK038623
SMILES OC(=O)/C=C/C(=O)Nc1ccccc1C#Cc1ccccc1
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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 C18H13NO3 MW 291.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13NO3/c20-17(12-13-18(21)22)19-16-9-5-4-8-15(16)11-10-14-6-2-1-3-7-14/h1-9,12-13H,(H,19,20)(H,21,22)/b13-12+InChIKey
HHHFPVVMOBYDSB-OUKQBFOZSA-NSynonyms
(2E)4OXO4((2(PHENYLETHYNYL)PHENYL)AMINO)BUT2ENOICACID
(E)4OXO4(2(2PHENYLETHYNYL)ANILINO)BUT2ENOICACID
C1=CC=C(C=C1)C#CC2=CC=CC=C2NC(=O)C=CC(=O)O
InChI=1SC18H13NO3c2017(121318(21)22)1916954815(16)1110146213714h191213H(H1920)(H2122)b1312+
MFCD00757531
OC(=O)C=CC(=O)Nc1ccccc1C#Cc1ccccc1
STK038623
ZINC000000062243
ZINC62243
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