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

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-[(2,4-dichlorophenyl)methyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-N-[(2,4-dichlorophenyl)methyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-N-[(2,4-dichlorophenyl)methyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-N-[(2,4-dichlorophenyl)methyl]-4-methylbenzenesulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-N-(2,4-dichlorobenzyl)-4-methyl-benzenesulfonamide Formula: C22H26Cl2N2O3S MolecularWeight: 469.42444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=C(C=C(C=C2)Cl)Cl)CC(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=C(C=C(C=C2)Cl)Cl)CC(=O)N3CCCCCC3

InChI

InChI=1S/C22H26Cl2N2O3S/c1-17-6-10-20(11-7-17)30(28,29)26(15-18-8-9-19(23)14-21(18)24)16-22(27)25-12-4-2-3-5-13-25/h6-11,14H,2-5,12-13,15-16H2,1H3