3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-(dimethylamino)-2-phenyl-ethyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-(dimethylamino)-2-phenyl-ethyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(dimethylamino)-2-phenyl-ethyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[2-(dimethylamino)-2-phenylethyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(dimethylamino)-2-phenylethyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(dimethylamino)-2-phenyl-ethyl]benzamide Formula: C23H30ClN3O3S MolecularWeight: 464.0206

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2)C3=CC=CC=C3

Isomeric SMILES

CN(C)C(CNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C23H30ClN3O3S/c1-26(2)21(18-10-6-5-7-11-18)17-25-23(28)19-12-13-20(24)22(16-19)31(29,30)27-14-8-3-4-9-15-27/h5-7,10-13,16,21H,3-4,8-9,14-15,17H2,1-2H3,(H,25,28)