5-(azepan-1-ylsulfonyl)-2-methoxy-N-[(4-methylphenyl)methyl]benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-[(4-methylphenyl)methyl]benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-(p-tolylmethyl)benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-methoxy-N-[(4-methylphenyl)methyl]benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-[(4-methylphenyl)methyl]benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-(4-methylbenzyl)benzamide Formula: C22H28N2O4S MolecularWeight: 416.53372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C22H28N2O4S/c1-17-7-9-18(10-8-17)16-23-22(25)20-15-19(11-12-21(20)28-2)29(26,27)24-13-5-3-4-6-14-24/h7-12,15H,3-6,13-14,16H2,1-2H3,(H,23,25)