4-(azepan-1-ylcarbonyl)-N-(3,4-dimethylphenyl)benzenesulfonamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-N-(3,4-dimethylphenyl)benzenesulfonamide Openeye Name: 4-(azepane-1-carbonyl)-N-(3,4-dimethylphenyl)benzenesulfonamide CAS Name: 4-[1-azepanyl(oxo)methyl]-N-(3,4-dimethylphenyl)benzenesulfonamide IUPAC Name: 4-(azepane-1-carbonyl)-N-(3,4-dimethylphenyl)benzenesulfonamide Traditional Name: 4-(azepane-1-carbonyl)-N-(3,4-dimethylphenyl)benzenesulfonamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCCCCC3)C

InChI

InChI=1S/C21H26N2O3S/c1-16-7-10-19(15-17(16)2)22-27(25,26)20-11-8-18(9-12-20)21(24)23-13-5-3-4-6-14-23/h7-12,15,22H,3-6,13-14H2,1-2H3