3-(azepan-1-ylcarbonyl)-4-chloranyl-N-ethyl-N-phenyl-benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-4-chloranyl-N-ethyl-N-phenyl-benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-4-chloro-N-ethyl-N-phenyl-benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-4-chloro-N-ethyl-N-phenylbenzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-4-chloro-N-ethyl-N-phenylbenzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-4-chloro-N-ethyl-N-phenyl-benzenesulfonamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCCCCC3

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCCCCC3

InChI

InChI=1S/C21H25ClN2O3S/c1-2-24(17-10-6-5-7-11-17)28(26,27)18-12-13-20(22)19(16-18)21(25)23-14-8-3-4-9-15-23/h5-7,10-13,16H,2-4,8-9,14-15H2,1H3