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

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methylbenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methylbenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-homoveratryl-2-methyl-benzamide Formula: C24H32N2O5S MolecularWeight: 460.58628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H32N2O5S/c1-18-8-10-20(32(28,29)26-14-6-4-5-7-15-26)17-21(18)24(27)25-13-12-19-9-11-22(30-2)23(16-19)31-3/h8-11,16-17H,4-7,12-15H2,1-3H3,(H,25,27)