N-[2-(azepan-1-ylcarbonyl)phenyl]-4-methoxy-3-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-4-methoxy-3-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-4-methoxy-3-(2-oxopyrrolidin-1-yl)benzenesulfonamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-4-methoxy-3-(2-oxo-1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-4-methoxy-3-(2-oxopyrrolidin-1-yl)benzenesulfonamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-3-(2-ketopyrrolidino)-4-methoxy-benzenesulfonamide Formula: C24H29N3O5S MolecularWeight: 471.56916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)N4CCCC4=O

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)N3CCCCCC3)N4CCCC4=O

InChI

InChI=1S/C24H29N3O5S/c1-32-22-13-12-18(17-21(22)27-16-8-11-23(27)28)33(30,31)25-20-10-5-4-9-19(20)24(29)26-14-6-2-3-7-15-26/h4-5,9-10,12-13,17,25H,2-3,6-8,11,14-16H2,1H3