Vitas-M small molecule compound

N-{(1Z)-1-(1,3-benzodioxol-5-yl)-3-[(3-hydroxypropyl)amino]-3-oxoprop-1-en-2-yl}-4-methoxybenzamide

Catalog ID
STL327525
SMILES OCCCNC(=O)/C(=C/c1ccc2c(c1)OCO2)/NC(=O)c1ccc(cc1)OC

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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 C21H22N2O6 MW 398.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O6/c1-27-16-6-4-15(5-7-16)20(25)23-17(21(26)22-9-2-10-24)11-14-3-8-18-19(12-14)29-13-28-18/h3-8,11-12,24H,2,9-10,13H2,1H3,(H,22,26)(H,23,25)/b17-11-
InChIKey
NHTZIUYICKNSFN-BOPFTXTBSA-N
Synonyms
373610-10-7
(Z)N(1(benzo(d)(13)dioxol5yl)3((3hydroxypropyl)amino)3oxoprop1en2yl)4methoxybenzamide
373610107
COC1=CC=C(C=C1)C(=O)NC(=CC2=CC3=C(C=C2)OCO3)C(=O)NCCCO
InChI=1SC21H22N2O6c127166415(5716)20(25)2317(21(26)22921024)1114381819(1214)29132818h38111224H291013H21H3(H2226)(H2325)b1711
MFCD01083643
N((1Z)1(13BENZODIOXOL5YL)3((3HYDROXYPROPYL)AMINO)3OXOPROP1EN2YL)4METHOXYBENZAMIDE
N((Z)1(13BENZODIOXOL5YL)3(3HYDROXYPROPYLAMINO)3OXOPROP1EN2YL)4METHOXYBENZAMIDE
OCCCNC(=O)C(=Cc1ccc2c(c1)OCO2)NC(=O)c1ccc(cc1)OC
ZINC000004806688
ZINC04806688
ZINC4806688

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Available files

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