3-(azepan-1-ylsulfonyl)-N-[1-(2,4-dimethylphenyl)ethyl]-4-methyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[1-(2,4-dimethylphenyl)ethyl]-4-methyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[1-(2,4-dimethylphenyl)ethyl]-4-methyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[1-(2,4-dimethylphenyl)ethyl]-4-methylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[1-(2,4-dimethylphenyl)ethyl]-4-methylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[1-(2,4-dimethylphenyl)ethyl]-4-methyl-benzamide Formula: C24H32N2O3S MolecularWeight: 428.58748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N2O3S/c1-17-9-12-22(19(3)15-17)20(4)25-24(27)21-11-10-18(2)23(16-21)30(28,29)26-13-7-5-6-8-14-26/h9-12,15-16,20H,5-8,13-14H2,1-4H3,(H,25,27)