Vitas-M small molecule compound

(2E)-3-(1,3-benzodioxol-5-yl)-N-[2-(1,3-benzodioxol-5-ylamino)-1-(4-methylphenyl)-2-oxoethyl]prop-2-enamide

Catalog ID
STK149209
SMILES Cc1ccc(cc1)C(C(=O)Nc1ccc2c(c1)OCO2)NC(=O)/C=C/c1ccc2c(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 C26H22N2O6 MW 458.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O6/c1-16-2-6-18(7-3-16)25(26(30)27-19-8-10-21-23(13-19)34-15-32-21)28-24(29)11-5-17-4-9-20-22(12-17)33-14-31-20/h2-13,25H,14-15H2,1H3,(H,27,30)(H,28,29)/b11-5+
InChIKey
BSEWAUSLBYUWKC-VZUCSPMQSA-N
Synonyms

(2E)3(13BENZODIOXOL5YL)N(2(13BENZODIOXOL5YLAMINO)1(4METHYLPHENYL)2OXOETHYL)PROP2ENAMIDE
(E)3(13BENZODIOXOL5YL)N(2(13BENZODIOXOL5YLAMINO)1(4METHYLPHENYL)2OXOETHYL)PROP2ENAMIDE
CC1=CC=C(C=C1)C(C(=O)NC2=CC3=C(C=C2)OCO3)NC(=O)C=CC4=CC5=C(C=C4)OCO5
Cc1ccc(cc1)C(C(=O)Nc1ccc2c(c1)OCO2)NC(=O)C=Cc1ccc2c(c1)OCO2
InChI=1SC26H22N2O6c1162618(7316)25(26(30)27198102123(1319)34153221)2824(29)11517492022(1217)33143120h21325H1415H21H3(H2730)(H2829)b115+
MFCD08674020
ZINC000003614869
ZINC000003614875

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Available files

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