Vitas-M small molecule compound
ethyl 2-({[4-(4-chlorophenoxy)-3-nitrophenyl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK753360
SMILES CCOC(=O)c1c(NC(=O)c2ccc(c(c2)[N+](=O)[O-])Oc2ccc(cc2)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 C24H21ClN2O6S MW 500.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21ClN2O6S/c1-2-32-24(29)21-17-5-3-4-6-20(17)34-23(21)26-22(28)14-7-12-19(18(13-14)27(30)31)33-16-10-8-15(25)9-11-16/h7-13H,2-6H2,1H3,(H,26,28)InChIKey
BVZNEVLHAPZUNB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=C(C=C3)OC4=CC=C(C=C4)Cl)(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)c2ccc(c(c2)(N+)(=O)(O))Oc2ccc(cc2)Cl)sc2c1CCCC2
ethyl2(((4(4chlorophenoxy)3nitrophenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((4(4chlorophenoxy)3nitrobenzoyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(4(4chlorophenoxy)3nitrobenzamido)4567tetrahydrobenzo(b)thiophene3carboxylate
InChI=1SC24H21ClN2O6Sc123224(29)2117534620(17)3423(21)2622(28)1471219(18(1314)27(30)31)331610815(25)91116h713H26H21H3(H2628)
MFCD00227186
ZINC000001799599
ZINC01799599
ZINC1799599
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