Vitas-M small molecule compound
(2Z)-4-({3-chloro-4-[(phenylacetyl)amino]phenyl}amino)-4-oxobut-2-enoic acid
Catalog ID
STK333937
SMILES O=C(Nc1ccc(cc1Cl)NC(=O)/C=C\C(=O)O)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 C18H15ClN2O4 MW 358.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN2O4/c19-14-11-13(20-16(22)8-9-18(24)25)6-7-15(14)21-17(23)10-12-4-2-1-3-5-12/h1-9,11H,10H2,(H,20,22)(H,21,23)(H,24,25)/b9-8-InChIKey
CXTAXJDEBIUGJR-HJWRWDBZSA-NSynonyms
(2Z)4((3chloro4((phenylacetyl)amino)phenyl)amino)4oxobut2enoicacid
(Z)4(3chloro4((2phenylacetyl)amino)anilino)4oxobut2enoicacid
C1=CC=C(C=C1)CC(=O)NC2=C(C=C(C=C2)NC(=O)C=CC(=O)O)Cl
InChI=1SC18H15ClN2O4c19141113(2016(22)8918(24)25)6715(14)2117(23)10124213512h1911H10H2(H2022)(H2123)(H2425)b98
MFCD09963316
O=C(Nc1ccc(cc1Cl)NC(=O)C=CC(=O)O)Cc1ccccc1
ZINC000018196513
ZINC18196513
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