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

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(3-chlorophenyl)-3-methyl-1-benzofuran-2-carboxamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(3-chlorophenyl)-3-methyl-benzofuran-2-carboxamide CAS Name: 5-(1-azepanylsulfonyl)-N-(3-chlorophenyl)-3-methyl-2-benzofurancarboxamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(3-chlorophenyl)-3-methyl-1-benzofuran-2-carboxamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(3-chlorophenyl)-3-methyl-coumarilamide Formula: C22H23ClN2O4S MolecularWeight: 446.94702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)C(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)C(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H23ClN2O4S/c1-15-19-14-18(30(27,28)25-11-4-2-3-5-12-25)9-10-20(19)29-21(15)22(26)24-17-8-6-7-16(23)13-17/h6-10,13-14H,2-5,11-12H2,1H3,(H,24,26)