Vitas-M small molecule compound

4-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-3-methyl-N-propylbenzenesulfonamide

Catalog ID
STL196421
SMILES CCCNS(=O)(=O)c1ccc(c(c1)C)OCC(=O)N1CCc2c(C1)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 C21H26N2O4S MW 402.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O4S/c1-3-11-22-28(25,26)19-8-9-20(16(2)13-19)27-15-21(24)23-12-10-17-6-4-5-7-18(17)14-23/h4-9,13,22H,3,10-12,14-15H2,1-2H3
InChIKey
DMLQDNGMFQWELS-UHFFFAOYSA-N
Synonyms

4(2(34DIHYDRO1HISOQUINOLIN2YL)2OXOETHOXY)3METHYLNPROPYLBENZENESULFONAMIDE
4(2(34dihydroisoquinolin2(1H)yl)2oxoethoxy)3methylNpropylbenzenesulfonamide
CCCNS(=O)(=O)C1=CC(=C(C=C1)OCC(=O)N2CCC3=CC=CC=C3C2)C
InChI=1SC21H26N2O4Sc13112228(2526)198920(16(2)1319)271521(24)23121017645718(17)1423h491322H310121415H212H3
MFCD07398733
ZINC000004943997
ZINC04943997
ZINC4943997

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Available files

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