Vitas-M small molecule compound

(2E)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-(furan-2-yl)prop-2-enamide

Catalog ID
STK411791
SMILES N#C/C(=C\c1ccco1)/C(=O)NCc1ccc2c(c1)OCO2

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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 C16H12N2O4 MW 296.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O4/c17-8-12(7-13-2-1-5-20-13)16(19)18-9-11-3-4-14-15(6-11)22-10-21-14/h1-7H,9-10H2,(H,18,19)/b12-7+
InChIKey
OFPMFTRNYYMPBH-KPKJPENVSA-N
Synonyms

(2E)N(13benzodioxol5ylmethyl)2cyano3(furan2yl)prop2enamide
(2E)N(2HBENZO(34D)13DIOXOLAN5YLMETHYL)2CYANO3(2FURYL)PROP2ENAMIDE
(E)N(13benzodioxol5ylmethyl)2cyano3(furan2yl)prop2enamide
C1OC2=C(O1)C=C(C=C2)CNC(=O)C(=CC3=CC=CO3)C#N
InChI=1SC16H12N2O4c17812(7132152013)16(19)18911341415(611)22102114h17H910H2(H1819)b127+
MFCD03214495
N#CC(=Cc1ccco1)C(=O)NCc1ccc2c(c1)OCO2
ZINC000006242801
ZINC06242801
ZINC6242801

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Available files

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