ethyl 2-methyl-5-[2-methylpropyl(phenylsulfonyl)amino]-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-[2-methylpropyl(phenylsulfonyl)amino]-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[benzenesulfonyl(isobutyl)amino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[benzenesulfonyl(2-methylpropyl)amino]-2-methyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[benzenesulfonyl(2-methylpropyl)amino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[besyl(isobutyl)amino]-2-methyl-benzofuran-3-carboxylic acid ethyl ester Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)N(CC(C)C)S(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)N(CC(C)C)S(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C22H25NO5S/c1-5-27-22(24)21-16(4)28-20-12-11-17(13-19(20)21)23(14-15(2)3)29(25,26)18-9-7-6-8-10-18/h6-13,15H,5,14H2,1-4H3