methyl 2-methyl-5-[naphthalen-2-ylsulfonyl(pyridin-4-ylcarbonyl)amino]-1-benzofuran-3-carboxylate

Systemtic Name: methyl 2-methyl-5-[naphthalen-2-ylsulfonyl(pyridin-4-ylcarbonyl)amino]-1-benzofuran-3-carboxylate Openeye Name: methyl 2-methyl-5-[2-naphthylsulfonyl(pyridine-4-carbonyl)amino]benzofuran-3-carboxylate CAS Name: 2-methyl-5-[2-naphthalenylsulfonyl-[oxo(pyridin-4-yl)methyl]amino]-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[naphthalen-2-ylsulfonyl(pyridine-4-carbonyl)amino]-1-benzofuran-3-carboxylate Traditional Name: 5-[isonicotinoyl(2-naphthylsulfonyl)amino]-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C27H20N2O6S MolecularWeight: 500.5225

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2)N(C(=O)C3=CC=NC=C3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2)N(C(=O)C3=CC=NC=C3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)C(=O)OC

InChI

InChI=1S/C27H20N2O6S/c1-17-25(27(31)34-2)23-16-21(8-10-24(23)35-17)29(26(30)19-11-13-28-14-12-19)36(32,33)22-9-7-18-5-3-4-6-20(18)15-22/h3-16H,1-2H3