3-(azepan-1-ylsulfonyl)-N-[(4-chlorophenyl)methyl]-N,4-dimethyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[(4-chlorophenyl)methyl]-N,4-dimethyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[(4-chlorophenyl)methyl]-N,4-dimethyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[(4-chlorophenyl)methyl]-N,4-dimethylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[(4-chlorophenyl)methyl]-N,4-dimethylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(4-chlorobenzyl)-N,4-dimethyl-benzamide Formula: C22H27ClN2O3S MolecularWeight: 434.97938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27ClN2O3S/c1-17-7-10-19(22(26)24(2)16-18-8-11-20(23)12-9-18)15-21(17)29(27,28)25-13-5-3-4-6-14-25/h7-12,15H,3-6,13-14,16H2,1-2H3