Vitas-M small molecule compound

4-(heptyloxy)-N-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)benzamide

Catalog ID
STK518401
SMILES CCCCCCCOc1ccc(cc1)C(=O)Nc1onc2c1CCCC2

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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 C21H28N2O3 MW 356.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O3/c1-2-3-4-5-8-15-25-17-13-11-16(12-14-17)20(24)22-21-18-9-6-7-10-19(18)23-26-21/h11-14H,2-10,15H2,1H3,(H,22,24)
InChIKey
JNXQBMWSOIGFIH-UHFFFAOYSA-N
Synonyms

4(heptyloxy)N(4567tetrahydro21benzoxazol3yl)benzamide
4heptoxyN(4567tetrahydro21benzoxazol3yl)benzamide
CCCCCCCOC1=CC=C(C=C1)C(=O)NC2=C3CCCCC3=NO2
InChI=1SC21H28N2O3c123458152517131116(121417)20(24)2221189671019(18)232621h1114H21015H21H3(H2224)
MFCD08550097
ZINC000098048200
ZINC98048200

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Available files

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