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

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[(4-methylphenyl)methyl]benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(p-tolylmethyl)benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[(4-methylphenyl)methyl]benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-[(4-methylphenyl)methyl]benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(4-methylbenzyl)benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H26N2O3S/c1-17-6-8-18(9-7-17)16-22-21(24)19-10-12-20(13-11-19)27(25,26)23-14-4-2-3-5-15-23/h6-13H,2-5,14-16H2,1H3,(H,22,24)