Vitas-M small molecule compound

4-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-methylbenzenesulfonamide

Catalog ID
STK319273
SMILES Clc1ccc(cc1)S(=O)(=O)N(CC(=O)N1CCc2c(C1)cccc2)C

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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 C18H19ClN2O3S MW 378.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClN2O3S/c1-20(25(23,24)17-8-6-16(19)7-9-17)13-18(22)21-11-10-14-4-2-3-5-15(14)12-21/h2-9H,10-13H2,1H3
InChIKey
PEGNBFIKHFPRAW-UHFFFAOYSA-N
Synonyms

4CHLORON(2(34DIHYDRO1HISOQUINOLIN2YL)2OXOETHYL)NMETHYLBENZENESULFONAMIDE
4CHLORON(2(34DIHYDROISOQUINOLIN2(1H)YL)2OXOETHYL)NMETHYLBENZENESULFONAMIDE
CN(CC(=O)N1CCC2=CC=CC=C2C1)S(=O)(=O)C3=CC=C(C=C3)Cl
InChI=1SC18H19ClN2O3Sc120(25(2324)178616(19)7917)1318(22)21111014423515(14)1221h29H1013H21H3
MFCD01644056
ZINC000000780740
ZINC00780740
ZINC780740

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Available files

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