3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[1-(4,5-dimethoxy-2-methyl-phenyl)ethyl]propanamide

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[1-(4,5-dimethoxy-2-methyl-phenyl)ethyl]propanamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[1-(4,5-dimethoxy-2-methyl-phenyl)ethyl]propanamide CAS Name: 3-[4-(1-azepanylsulfonyl)phenyl]-N-[1-(4,5-dimethoxy-2-methylphenyl)ethyl]propanamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[1-(4,5-dimethoxy-2-methylphenyl)ethyl]propanamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[1-(4,5-dimethoxy-2-methyl-phenyl)ethyl]propionamide Formula: C26H36N2O5S MolecularWeight: 488.63944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(C)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1C(C)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)OC)OC

InChI

InChI=1S/C26H36N2O5S/c1-19-17-24(32-3)25(33-4)18-23(19)20(2)27-26(29)14-11-21-9-12-22(13-10-21)34(30,31)28-15-7-5-6-8-16-28/h9-10,12-13,17-18,20H,5-8,11,14-16H2,1-4H3,(H,27,29)