5-(azepan-1-ylsulfonyl)-N-(5-chloranyl-2-methyl-phenyl)-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(5-chloranyl-2-methyl-phenyl)-3-methyl-1-benzofuran-2-carboxamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(5-chloro-2-methyl-phenyl)-3-methyl-benzofuran-2-carboxamide CAS Name: 5-(1-azepanylsulfonyl)-N-(5-chloro-2-methylphenyl)-3-methyl-2-benzofurancarboxamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(5-chloro-2-methylphenyl)-3-methyl-1-benzofuran-2-carboxamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(5-chloro-2-methyl-phenyl)-3-methyl-coumarilamide Formula: C23H25ClN2O4S MolecularWeight: 460.9736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)C2=C(C3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)C2=C(C3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCCCC4)C

InChI

InChI=1S/C23H25ClN2O4S/c1-15-7-8-17(24)13-20(15)25-23(27)22-16(2)19-14-18(9-10-21(19)30-22)31(28,29)26-11-5-3-4-6-12-26/h7-10,13-14H,3-6,11-12H2,1-2H3,(H,25,27)