Vitas-M small molecule compound
ethyl 5-{[(4-chlorophenyl)sulfonyl][(4-nitrophenyl)carbonyl]amino}-2-methyl-1-benzofuran-3-carboxylate
Catalog ID
STK238327
SMILES CCOC(=O)c1c(C)oc2c1cc(cc2)N(S(=O)(=O)c1ccc(cc1)Cl)C(=O)c1ccc(cc1)[N+](=O)[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 C25H19ClN2O8S MW 542.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19ClN2O8S/c1-3-35-25(30)23-15(2)36-22-13-10-19(14-21(22)23)27(37(33,34)20-11-6-17(26)7-12-20)24(29)16-4-8-18(9-5-16)28(31)32/h4-14H,3H2,1-2H3InChIKey
BYSZHNLXVXOAKL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(OC2=C1C=C(C=C2)N(C(=O)C3=CC=C(C=C3)(N+)(=O)(O))S(=O)(=O)C4=CC=C(C=C4)Cl)C
CCOC(=O)c1c(C)oc2c1cc(cc2)N(S(=O)(=O)c1ccc(cc1)Cl)C(=O)c1ccc(cc1)(N+)(=O)(O)
ethyl5(((4chlorophenyl)sulfonyl)((4nitrophenyl)carbonyl)amino)2methyl1benzofuran3carboxylate
ETHYL5((4CHLOROPHENYL)SULFONYL(4NITROBENZOYL)AMINO)2METHYL1BENZOFURAN3CARBOXYLATE
InChI=1SC25H19ClN2O8Sc133525(30)2315(2)3622131019(1421(22)23)27(37(3334)2011617(26)71220)24(29)164818(9516)28(31)32h414H3H212H3
MFCD02345665
ZINC000098045666
ZINC98045666
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