3-(azepan-1-ylcarbonyl)-4-methoxy-N-(2-pyrrolidin-1-ylcarbonylphenyl)benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-4-methoxy-N-(2-pyrrolidin-1-ylcarbonylphenyl)benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-4-methoxy-N-[2-[oxo(1-pyrrolidinyl)methyl]phenyl]benzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-4-methoxy-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzenesulfonamide Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)N3CCCC3)C(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)N3CCCC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C25H31N3O5S/c1-33-23-13-12-19(18-21(23)25(30)28-14-6-2-3-7-15-28)34(31,32)26-22-11-5-4-10-20(22)24(29)27-16-8-9-17-27/h4-5,10-13,18,26H,2-3,6-9,14-17H2,1H3