Vitas-M small molecule compound

methyl 2-({3-[(phenylsulfonyl)amino]quinoxalin-2-yl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK538649
SMILES COC(=O)c1c(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccccc2)sc2c1CCCC2

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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 C24H22N4O4S2 MW 494.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O4S2/c1-32-24(29)20-16-11-5-8-14-19(16)33-23(20)27-21-22(26-18-13-7-6-12-17(18)25-21)28-34(30,31)15-9-3-2-4-10-15/h2-4,6-7,9-10,12-13H,5,8,11,14H2,1H3,(H,25,27)(H,26,28)
InChIKey
PEBCLDNWUUCGIB-UHFFFAOYSA-N
Synonyms
488825-86-1
488825861
COC(=O)C1=C(SC2=C1CCCC2)NC3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=CC=C5
InChI=1SC24H22N4O4S2c13224(29)201611581419(16)3323(20)272122(261813761217(18)2521)2834(3031)1593241015h24679101213H581114H21H3(H2527)(H2628)
methyl2((3((phenylsulfonyl)amino)quinoxalin2yl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((3(benzenesulfonamido)quinoxalin2yl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((3(phenylsulfonamido)quinoxalin2yl)amino)4567tetrahydrobenzo(b)thiophene3carboxylate
MFCD03293962
ZINC000002372577
ZINC02372577
ZINC2372577

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Available files

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