N-[2-(azepan-1-ylcarbonyl)-1-benzothiophen-5-yl]-N-[(4-chlorophenyl)methyl]methanesulfonamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)-1-benzothiophen-5-yl]-N-[(4-chlorophenyl)methyl]methanesulfonamide Openeye Name: N-[2-(azepane-1-carbonyl)benzothiophen-5-yl]-N-[(4-chlorophenyl)methyl]methanesulfonamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]-1-benzothiophen-5-yl]-N-[(4-chlorophenyl)methyl]methanesulfonamide IUPAC Name: N-[2-(azepane-1-carbonyl)-1-benzothiophen-5-yl]-N-[(4-chlorophenyl)methyl]methanesulfonamide Traditional Name: N-[2-(azepane-1-carbonyl)benzothiophen-5-yl]-N-(4-chlorobenzyl)methanesulfonamide Formula: C23H25ClN2O3S2 MolecularWeight: 477.0392

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=C(C=C1)Cl)C2=CC3=C(C=C2)SC(=C3)C(=O)N4CCCCCC4

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=C(C=C1)Cl)C2=CC3=C(C=C2)SC(=C3)C(=O)N4CCCCCC4

InChI

InChI=1S/C23H25ClN2O3S2/c1-31(28,29)26(16-17-6-8-19(24)9-7-17)20-10-11-21-18(14-20)15-22(30-21)23(27)25-12-4-2-3-5-13-25/h6-11,14-15H,2-5,12-13,16H2,1H3