Vitas-M small molecule compound

N-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide

Catalog ID
STK943506
SMILES COc1c(OC)cc(cc1OC)NC(=O)c1noc2c1CCCCC2

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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 C18H22N2O5 MW 346.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O5/c1-22-14-9-11(10-15(23-2)17(14)24-3)19-18(21)16-12-7-5-4-6-8-13(12)25-20-16/h9-10H,4-8H2,1-3H3,(H,19,21)
InChIKey
YEEMVDBMVGXPSD-UHFFFAOYSA-N
Synonyms
912879-54-0
912879540
COC1=CC(=CC(=C1OC)OC)NC(=O)C2=NOC3=C2CCCCC3
InChI=1SC18H22N2O5c12214911(1015(232)17(14)243)1918(21)16127546813(12)252016h910H48H213H3(H1921)
MFCD09783100
N(345trimethoxyphenyl)5678tetrahydro4Hcyclohepta(d)(12)oxazole3carboxamide
N(345trimethoxyphenyl)5678tetrahydro4Hcyclohepta(d)isoxazole3carboxamide
ZINC000000426582
ZINC00426582
ZINC426582

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Available files

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