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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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