Vitas-M small molecule compound
N-(3-acetyl-2-methyl-1-benzofuran-5-yl)-N-(naphthalen-2-ylsulfonyl)-4-nitrobenzamide
Catalog ID
STK238317
SMILES CC(=O)c1c(C)oc2c1cc(cc2)N(S(=O)(=O)c1ccc2c(c1)cccc2)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 C28H20N2O7S MW 528.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20N2O7S/c1-17(31)27-18(2)37-26-14-12-23(16-25(26)27)29(28(32)20-7-10-22(11-8-20)30(33)34)38(35,36)24-13-9-19-5-3-4-6-21(19)15-24/h3-16H,1-2H3InChIKey
XOUZMRJNVPUDEU-UHFFFAOYSA-NSynonyms
CC(=O)c1c(C)oc2c1cc(cc2)N(S(=O)(=O)c1ccc2c(c1)cccc2)C(=O)c1ccc(cc1)(N+)(=O)(O)
CC1=C(C2=C(O1)C=CC(=C2)N(C(=O)C3=CC=C(C=C3)(N+)(=O)(O))S(=O)(=O)C4=CC5=CC=CC=C5C=C4)C(=O)C
InChI=1SC28H20N2O7Sc117(31)2718(2)3726141223(1625(26)27)29(28(32)2071022(11820)30(33)34)38(3536)2413919534621(19)1524h316H12H3
MFCD02345502
N(3acetyl2methyl1benzofuran5yl)N(naphthalen2ylsulfonyl)4nitrobenzamide
N(3acetyl2methyl1benzofuran5yl)Nnaphthalen2ylsulfonyl4nitrobenzamide
ZINC000098045664
ZINC98045664
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