Vitas-M small molecule compound

(2E)-3-(6-chloro-4-oxo-4H-chromen-3-yl)-2-cyano-N-(2-methoxyphenyl)prop-2-enamide

Catalog ID
STK431444
SMILES N#C/C(=C\c1coc2c(c1=O)cc(cc2)Cl)/C(=O)Nc1ccccc1OC

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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 C20H13ClN2O4 MW 380.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13ClN2O4/c1-26-18-5-3-2-4-16(18)23-20(25)12(10-22)8-13-11-27-17-7-6-14(21)9-15(17)19(13)24/h2-9,11H,1H3,(H,23,25)/b12-8+
InChIKey
GNDHBTRUAJHXGT-XYOKQWHBSA-N
Synonyms

(2E)3(6chloro4oxo4Hchromen3yl)2cyanoN(2methoxyphenyl)prop2enamide
(2E)3(6CHLORO4OXOCHROMEN3YL)2CYANON(2METHOXYPHENYL)PROP2ENAMIDE
(E)3(6CHLORO4OXOCHROMEN3YL)2CYANON(2METHOXYPHENYL)PROP2ENAMIDE
COC1=CC=CC=C1NC(=O)C(=CC2=COC3=C(C2=O)C=C(C=C3)Cl)C#N
InChI=1SC20H13ClN2O4c12618532416(18)2320(25)12(1022)8131127177614(21)915(17)19(13)24h2911H1H3(H2325)b128+
MFCD03466206
N#CC(=Cc1coc2c(c1=O)cc(cc2)Cl)C(=O)Nc1ccccc1OC
ZINC000002749311
ZINC02749311
ZINC2749311

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Available files

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