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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[(4-chlorophenyl)methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[(4-chlorophenyl)methyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[(4-chlorophenyl)methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[(4-chlorophenyl)methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(4-chlorobenzyl)benzamide Formula: C20H23ClN2O3S MolecularWeight: 406.92622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H23ClN2O3S/c21-18-10-8-16(9-11-18)15-22-20(24)17-6-5-7-19(14-17)27(25,26)23-12-3-1-2-4-13-23/h5-11,14H,1-4,12-13,15H2,(H,22,24)