Vitas-M small molecule compound

N-benzyl-1-oxo-2-(3,4,5-trimethoxyphenyl)-1,2-dihydroisoquinoline-4-carboxamide

Catalog ID
STL250259
SMILES COc1cc(cc(c1OC)OC)n1cc(C(=O)NCc2ccccc2)c2c(c1=O)cccc2

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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 C26H24N2O5 MW 444.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O5/c1-31-22-13-18(14-23(32-2)24(22)33-3)28-16-21(19-11-7-8-12-20(19)26(28)30)25(29)27-15-17-9-5-4-6-10-17/h4-14,16H,15H2,1-3H3,(H,27,29)
InChIKey
IOAIQWJIWHJYCR-UHFFFAOYSA-N
Synonyms
1351687-40-5
1351687405
COC1=CC(=CC(=C1OC)OC)N2C=C(C3=CC=CC=C3C2=O)C(=O)NCC4=CC=CC=C4
InChI=1SC26H24N2O5c131221318(1423(322)24(22)333)281621(1911781220(19)26(28)30)25(29)27151795461017h41416H15H213H3(H2729)
MFCD20535906
Nbenzyl1oxo2(345trimethoxyphenyl)12dihydroisoquinoline4carboxamide
Nbenzyl1oxo2(345trimethoxyphenyl)isoquinoline4carboxamide
ZINC000072400707
ZINC72400707

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Available files

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