3-(azepan-1-ylsulfonyl)-N-(3,5-dimethylphenyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(3,5-dimethylphenyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(3,5-dimethylphenyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(3,5-dimethylphenyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(3,5-dimethylphenyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(3,5-dimethylphenyl)benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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