N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(6-methyl-1-benzofuran-3-yl)ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(6-methyl-1-benzofuran-3-yl)ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(6-methylbenzofuran-3-yl)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-(6-methyl-3-benzofuranyl)acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(6-methyl-1-benzofuran-3-yl)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(6-methylbenzofuran-3-yl)acetamide Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CO2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CO2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H26N2O4S/c1-17-9-10-21-18(16-29-22(21)13-17)14-23(26)24-19-7-6-8-20(15-19)30(27,28)25-11-4-2-3-5-12-25/h6-10,13,15-16H,2-5,11-12,14H2,1H3,(H,24,26)