Vitas-M small molecule compound

N-[5-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxy-2-methylphenyl]-4-methoxybenzenesulfonamide

Catalog ID
STK229986
SMILES COc1ccc(cc1)S(=O)(=O)Nc1cc(Sc2nc3c(s2)cccc3)c(cc1C)O

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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 C21H18N2O4S3 MW 458.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O4S3/c1-13-11-18(24)20(29-21-22-16-5-3-4-6-19(16)28-21)12-17(13)23-30(25,26)15-9-7-14(27-2)8-10-15/h3-12,23-24H,1-2H3
InChIKey
YHDLIVFKAHELQI-UHFFFAOYSA-N
Synonyms
848335-36-4
848335364
CC1=CC(=C(C=C1NS(=O)(=O)C2=CC=C(C=C2)OC)SC3=NC4=CC=CC=C4S3)O
InChI=1SC21H18N2O4S3c1131118(24)20(29212216534619(16)2821)1217(13)2330(2526)159714(272)81015h3122324H12H3
MFCD07330358
N(5(13benzothiazol2ylsulfanyl)4hydroxy2methylphenyl)4methoxybenzenesulfonamide
ZINC000008870379
ZINC08870379
ZINC8870379

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Available files

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