Vitas-M small molecule compound
methyl 5-{[(4-bromophenyl)sulfonyl][(4-nitrophenyl)carbonyl]amino}-2-methyl-1-benzofuran-3-carboxylate
Catalog ID
STK238334
SMILES COC(=O)c1c(C)oc2c1cc(cc2)N(S(=O)(=O)c1ccc(cc1)Br)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 C24H17BrN2O8S MW 573.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17BrN2O8S/c1-14-22(24(29)34-2)20-13-18(9-12-21(20)35-14)26(36(32,33)19-10-5-16(25)6-11-19)23(28)15-3-7-17(8-4-15)27(30)31/h3-13H,1-2H3InChIKey
LPHLTDMAAKRXOO-UHFFFAOYSA-NSynonyms
CC1=C(C2=C(O1)C=CC(=C2)N(C(=O)C3=CC=C(C=C3)(N+)(=O)(O))S(=O)(=O)C4=CC=C(C=C4)Br)C(=O)OC
COC(=O)c1c(C)oc2c1cc(cc2)N(S(=O)(=O)c1ccc(cc1)Br)C(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC24H17BrN2O8Sc11422(24(29)342)201318(91221(20)3514)26(36(3233)1910516(25)61119)23(28)153717(8415)27(30)31h313H12H3
methyl5(((4bromophenyl)sulfonyl)((4nitrophenyl)carbonyl)amino)2methyl1benzofuran3carboxylate
methyl5((4bromophenyl)sulfonyl(4nitrobenzoyl)amino)2methyl1benzofuran3carboxylate
MFCD02345822
ZINC000059524407
ZINC59524407
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