Vitas-M small molecule compound

(2E)-N-(5-chloro-2-methoxyphenyl)-2-cyano-3-(1H-pyrrol-2-yl)prop-2-enamide

Catalog ID
STK431320
SMILES N#C/C(=C\c1[nH]ccc1)/C(=O)Nc1cc(Cl)ccc1OC

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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 C15H12ClN3O2 MW 301.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12ClN3O2/c1-21-14-5-4-11(16)8-13(14)19-15(20)10(9-17)7-12-3-2-6-18-12/h2-8,18H,1H3,(H,19,20)/b10-7+
InChIKey
KRAQOWSVEUAZNW-JXMROGBWSA-N
Synonyms

(2E)N(5chloro2methoxyphenyl)2cyano3(1Hpyrrol2yl)prop2enamide
(2E)N(5CHLORO2METHOXYPHENYL)2CYANO3PYRROL2YLPROP2ENAMIDE
(E)N(5CHLORO2METHOXYPHENYL)2CYANO3(1HPYRROL2YL)PROP2ENAMIDE
COC1=C(C=C(C=C1)Cl)NC(=O)C(=CC2=CC=CN2)C#N
InChI=1SC15H12ClN3O2c121145411(16)813(14)1915(20)10(917)7123261812h2818H1H3(H1920)b107+
MFCD03466013
N#CC(=Cc1(nH)ccc1)C(=O)Nc1cc(Cl)ccc1OC
ZINC000002743979
ZINC02743979
ZINC2743979

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Available files

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