3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(4-methylphenyl)propanamide

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(4-methylphenyl)propanamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(p-tolyl)propanamide CAS Name: 3-[4-(1-azepanylsulfonyl)phenyl]-N-(4-methylphenyl)propanamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(4-methylphenyl)propanamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(p-tolyl)propionamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H28N2O3S/c1-18-6-11-20(12-7-18)23-22(25)15-10-19-8-13-21(14-9-19)28(26,27)24-16-4-2-3-5-17-24/h6-9,11-14H,2-5,10,15-17H2,1H3,(H,23,25)