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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-(4-methylphenyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-(p-tolyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methyl-N-(4-methylphenyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-(4-methylphenyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-methyl-N-(p-tolyl)benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O3S/c1-16-7-11-19(12-8-16)22-21(24)18-10-9-17(2)20(15-18)27(25,26)23-13-5-3-4-6-14-23/h7-12,15H,3-6,13-14H2,1-2H3,(H,22,24)