Vitas-M small molecule compound

N-(1,3-benzodioxol-5-ylmethyl)-N'-(4-phenylbutan-2-yl)butanediamide

Catalog ID
STK057453
SMILES CC(NC(=O)CCC(=O)NCc1ccc2c(c1)OCO2)CCc1ccccc1

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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 C22H26N2O4 MW 382.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O4/c1-16(7-8-17-5-3-2-4-6-17)24-22(26)12-11-21(25)23-14-18-9-10-19-20(13-18)28-15-27-19/h2-6,9-10,13,16H,7-8,11-12,14-15H2,1H3,(H,23,25)(H,24,26)
InChIKey
VXIXHLRFWAQPGP-UHFFFAOYSA-N
Synonyms

CC(CCC1=CC=CC=C1)NC(=O)CCC(=O)NCC2=CC3=C(C=C2)OCO3
CC(NC(=O)CCC(=O)NCc1ccc2c(c1)OCO2)CCc1ccccc1
InChI=1SC22H26N2O4c116(78175324617)2422(26)121121(25)2314189101920(1318)28152719h269101316H7811121415H21H3(H2325)(H2426)
MFCD08051388
N(13BENZODIOXOL5YLMETHYL)N(4PHENYLBUTAN2YL)BUTANEDIAMIDE
STK057453
ZINC000013895942
ZINC000013895946

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.