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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-[(3-methylphenyl)methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-(m-tolylmethyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methyl-N-[(3-methylphenyl)methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-[(3-methylphenyl)methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-(3-methylbenzyl)benzamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O3S/c1-17-8-7-9-19(14-17)16-23-22(25)20-11-10-18(2)21(15-20)28(26,27)24-12-5-3-4-6-13-24/h7-11,14-15H,3-6,12-13,16H2,1-2H3,(H,23,25)