5-(azepan-1-ylsulfonyl)-N-(3,5-dimethylphenyl)-2-methyl-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(3,5-dimethylphenyl)-2-methyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(3,5-dimethylphenyl)-2-methyl-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-(3,5-dimethylphenyl)-2-methylbenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(3,5-dimethylphenyl)-2-methylbenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(3,5-dimethylphenyl)-2-methyl-benzamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=CC(=CC(=C3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C22H28N2O3S/c1-16-12-17(2)14-19(13-16)23-22(25)21-15-20(9-8-18(21)3)28(26,27)24-10-6-4-5-7-11-24/h8-9,12-15H,4-7,10-11H2,1-3H3,(H,23,25)