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

Systemtic Name: 5-(azepan-1-ylsulfonyl)-3-methyl-N-phenethyl-1-benzofuran-2-carboxamide Openeye Name: 5-(azepan-1-ylsulfonyl)-3-methyl-N-phenethyl-benzofuran-2-carboxamide CAS Name: 5-(1-azepanylsulfonyl)-3-methyl-N-phenethyl-2-benzofurancarboxamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-3-methyl-N-phenethyl-1-benzofuran-2-carboxamide Traditional Name: 5-(azepan-1-ylsulfonyl)-3-methyl-N-phenethyl-coumarilamide Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C24H28N2O4S/c1-18-21-17-20(31(28,29)26-15-7-2-3-8-16-26)11-12-22(21)30-23(18)24(27)25-14-13-19-9-5-4-6-10-19/h4-6,9-12,17H,2-3,7-8,13-16H2,1H3,(H,25,27)