5-(azepan-1-ylsulfonyl)-N-(2,6-dimethylphenyl)-2-methyl-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(2,6-dimethylphenyl)-2-methyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(2,6-dimethylphenyl)-2-methyl-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-(2,6-dimethylphenyl)-2-methylbenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(2,6-dimethylphenyl)-2-methylbenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(2,6-dimethylphenyl)-2-methyl-benzamide Formula: C22H28N2O3S MolecularWeight: 400.53432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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