Vitas-M small molecule compound

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

Catalog ID
STK098632
SMILES COc1ccc(cc1Cl)N(S(=O)(=O)c1ccc(cc1)C)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 C25H25ClN2O4S MW 485.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN2O4S/c1-18-7-10-22(11-8-18)33(30,31)28(21-9-12-24(32-2)23(26)15-21)17-25(29)27-14-13-19-5-3-4-6-20(19)16-27/h3-12,15H,13-14,16-17H2,1-2H3
InChIKey
SUMJYAWXLJCIRO-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC3=CC=CC=C3C2)C4=CC(=C(C=C4)OC)Cl
COc1ccc(cc1Cl)N(S(=O)(=O)c1ccc(cc1)C)CC(=O)N1CCc2c(C1)cccc2
InChI=1SC25H25ClN2O4Sc11871022(11818)33(3031)28(2191224(322)23(26)1521)1725(29)27141319534620(19)1627h31215H13141617H212H3
MFCD02946114
N(3CHLORO4METHOXYPHENYL)N(2(34DIHYDRO1HISOQUINOLIN2YL)2OXOETHYL)4METHYLBENZENESULFONAMIDE
N(3CHLORO4METHOXYPHENYL)N(2(34DIHYDROISOQUINOLIN2(1H)YL)2OXOETHYL)4METHYLBENZENESULFONAMIDE
STK098632
ZINC000000979385
ZINC00979385
ZINC979385

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Available files

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