Vitas-M small molecule compound
4-{5-[(1E)-3-amino-2-cyano-3-oxoprop-1-en-1-yl]furan-2-yl}benzoic acid
Catalog ID
STK003586
SMILES N#C/C(=C\c1ccc(o1)c1ccc(cc1)C(=O)O)/C(=O)N
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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 C15H10N2O4 MW 282.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H10N2O4/c16-8-11(14(17)18)7-12-5-6-13(21-12)9-1-3-10(4-2-9)15(19)20/h1-7H,(H2,17,18)(H,19,20)/b11-7+InChIKey
DWCDKJRRKOEGPC-YRNVUSSQSA-NSynonyms
340212-40-0(Z)4(5(3amino2cyano3oxoprop1en1yl)furan2yl)benzoicacid
340212400
4(5((1E)2CARBAMOYL2CYANOVINYL)2FURYL)BENZOICACID
4(5((1E)3AMINO2CYANO3OXOPROP1EN1YL)FURAN2YL)BENZOICACID
4(5((E)3AMINO2CYANO3OXOPROP1ENYL)FURAN2YL)BENZOICACID
C1=CC(=CC=C1C2=CC=C(O2)C=C(C#N)C(=O)N)C(=O)O
InChI=1SC15H10N2O4c16811(14(17)18)7125613(2112)91310(429)15(19)20h17H(H21718)(H1920)b117+
MFCD02192392
N#CC(=Cc1ccc(o1)c1ccc(cc1)C(=O)O)C(=O)N
STK003586
ZINC000002228681
ZINC2228681
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