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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2=C(C3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2=C(C3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCCCC4)C

InChI

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