3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[[1-(dimethylamino)cyclohexyl]methyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[[1-(dimethylamino)cyclohexyl]methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[[1-(dimethylamino)cyclohexyl]methyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[[1-(dimethylamino)cyclohexyl]methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[[1-(dimethylamino)cyclohexyl]methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[[1-(dimethylamino)cyclohexyl]methyl]benzamide Formula: C22H34ClN3O3S MolecularWeight: 456.04166

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1(CCCCC1)CNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(C)C1(CCCCC1)CNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H34ClN3O3S/c1-25(2)22(12-6-5-7-13-22)17-24-21(27)18-10-11-19(23)20(16-18)30(28,29)26-14-8-3-4-9-15-26/h10-11,16H,3-9,12-15,17H2,1-2H3,(H,24,27)