Vitas-M small molecule compound

ethyl 2-chloro-5-{5-[(1Z)-2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl]furan-2-yl}benzoate

Catalog ID
STK720245
SMILES CCOC(=O)/C(=C\c1ccc(o1)c1ccc(c(c1)C(=O)OCC)Cl)/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 C19H16ClNO5 MW 373.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClNO5/c1-3-24-18(22)13(11-21)9-14-6-8-17(26-14)12-5-7-16(20)15(10-12)19(23)25-4-2/h5-10H,3-4H2,1-2H3/b13-9-
InChIKey
XMPADOYQGNXPEY-LCYFTJDESA-N
Synonyms

CCOC(=O)C(=Cc1ccc(o1)c1ccc(c(c1)C(=O)OCC)Cl)C#N
CCOC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)C=C(C#N)C(=O)OCC)Cl
ethyl2chloro5(5((1Z)2cyano3ethoxy3oxoprop1en1yl)furan2yl)benzoate
ETHYL2CHLORO5(5((Z)2CYANO3ETHOXY3OXOPROP1ENYL)FURAN2YL)BENZOATE
InChI=1SC19H16ClNO5c132418(22)13(1121)9146817(2614)125716(20)15(1012)19(23)2542h510H34H212H3b139
MFCD13371691
ZINC000001064061
ZINC01064061
ZINC1064061

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Available files

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