Vitas-M small molecule compound
methyl 5-{5-[(1Z)-3-amino-2-cyano-3-oxoprop-1-en-1-yl]furan-2-yl}-2-chlorobenzoate
Catalog ID
STK389044
SMILES COC(=O)c1cc(ccc1Cl)c1ccc(o1)/C=C(\C(=O)N)/C#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 C16H11ClN2O4 MW 330.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11ClN2O4/c1-22-16(21)12-7-9(2-4-13(12)17)14-5-3-11(23-14)6-10(8-18)15(19)20/h2-7H,1H3,(H2,19,20)/b10-6-InChIKey
PVCYOFKHQWILHY-POHAHGRESA-NSynonyms
COC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)C=C(C#N)C(=O)N)Cl
COC(=O)c1cc(ccc1Cl)c1ccc(o1)C=C(C(=O)N)C#N
InChI=1SC16H11ClN2O4c12216(21)1279(2413(12)17)145311(2314)610(818)15(19)20h27H1H3(H21920)b106
METHYL5(5((1Z)3AMINO2CYANO3OXOPROP1EN1YL)FURAN2YL)2CHLOROBENZOATE
METHYL5(5((Z)3AMINO2CYANO3OXOPROP1ENYL)FURAN2YL)2CHLOROBENZOATE
MFCD01445952
ZINC000000284900
ZINC00284900
ZINC284900
Check stock
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Check stock on Vitas-MAvailable files
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