Vitas-M small molecule compound
methyl 2-[(3-{[(4-chloro-3-nitrophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK538452
SMILES COC(=O)c1c(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccc(c(c2)[N+](=O)[O-])Cl)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 C24H20ClN5O6S2 MW 574.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN5O6S2/c1-36-24(31)20-14-6-2-5-9-19(14)37-23(20)28-21-22(27-17-8-4-3-7-16(17)26-21)29-38(34,35)13-10-11-15(25)18(12-13)30(32)33/h3-4,7-8,10-12H,2,5-6,9H2,1H3,(H,26,28)(H,27,29)InChIKey
XTQULGORYMZMSI-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCCC2)NC3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC(=C(C=C5)Cl)(N+)(=O)(O)
COC(=O)c1c(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccc(c(c2)(N+)(=O)(O))Cl)sc2c1CCCC2
InChI=1SC24H20ClN5O6S2c13624(31)2014625919(14)3723(20)282122(2717843716(17)2621)2938(3435)13101115(25)18(1213)30(32)33h34781012H2569H21H3(H2628)(H2729)
methyl2((3(((4chloro3nitrophenyl)sulfonyl)amino)quinoxalin2yl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((3((4chloro3nitrophenyl)sulfonylamino)quinoxalin2yl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((3(4chloro3nitrophenylsulfonamido)quinoxalin2yl)amino)4567tetrahydrobenzo(b)thiophene3carboxylate
MFCD03299715
ZINC000096022153
ZINC96022153
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