Vitas-M small molecule compound

N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-(4-ethoxyphenyl)-4-fluorobenzenesulfonamide

Catalog ID
STK358324
SMILES CCOc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)F)CC(=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 C25H25FN2O4S MW 468.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25FN2O4S/c1-2-32-23-11-9-22(10-12-23)28(33(30,31)24-13-7-21(26)8-14-24)18-25(29)27-16-15-19-5-3-4-6-20(19)17-27/h3-14H,2,15-18H2,1H3
InChIKey
RRSGDVDJCNLCPI-UHFFFAOYSA-N
Synonyms

CCOC1=CC=C(C=C1)N(CC(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C4=CC=C(C=C4)F
InChI=1SC25H25FN2O4Sc12322311922(101223)28(33(3031)2413721(26)81424)1825(29)27161519534620(19)1727h314H21518H21H3
MFCD05835316
N(2(34DIHYDRO1HISOQUINOLIN2YL)2OXOETHYL)N(4ETHOXYPHENYL)4FLUOROBENZENESULFONAMIDE
N(2(34DIHYDROISOQUINOLIN2(1H)YL)2OXOETHYL)N(4ETHOXYPHENYL)4FLUOROBENZENESULFONAMIDE
ZINC000002877068
ZINC02877068
ZINC2877068

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Available files

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