5-(azepan-1-ylsulfonyl)-N-(3-ethoxyphenyl)-2-methyl-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(3-ethoxyphenyl)-2-methyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(3-ethoxyphenyl)-2-methyl-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-(3-ethoxyphenyl)-2-methylbenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(3-ethoxyphenyl)-2-methylbenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-methyl-N-m-phenetyl-benzamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C22H28N2O4S/c1-3-28-19-10-8-9-18(15-19)23-22(25)21-16-20(12-11-17(21)2)29(26,27)24-13-6-4-5-7-14-24/h8-12,15-16H,3-7,13-14H2,1-2H3,(H,23,25)