N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-[(2,4-dichlorophenyl)methyl]benzenesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-[(2,4-dichlorophenyl)methyl]benzenesulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-N-[(2,4-dichlorophenyl)methyl]benzenesulfonamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-N-[(2,4-dichlorophenyl)methyl]benzenesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-N-[(2,4-dichlorophenyl)methyl]benzenesulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-N-(2,4-dichlorobenzyl)benzenesulfonamide Formula: C21H24Cl2N2O3S MolecularWeight: 455.39786

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN(CC2=C(C=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)CN(CC2=C(C=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24Cl2N2O3S/c22-18-11-10-17(20(23)14-18)15-25(29(27,28)19-8-4-3-5-9-19)16-21(26)24-12-6-1-2-7-13-24/h3-5,8-11,14H,1-2,6-7,12-13,15-16H2