2,5-dimethoxy-N-[[3-methoxy-4-(2-pyridin-2-ylethoxy)phenyl]methyl]-N-[(3S)-2-oxidanylideneazepan-3-yl]benzenesulfonamide

Systemtic Name: 2,5-dimethoxy-N-[[3-methoxy-4-(2-pyridin-2-ylethoxy)phenyl]methyl]-N-[(3S)-2-oxidanylideneazepan-3-yl]benzenesulfonamide Openeye Name: 2,5-dimethoxy-N-[[3-methoxy-4-[2-(2-pyridyl)ethoxy]phenyl]methyl]-N-[(3S)-2-oxoazepan-3-yl]benzenesulfonamide CAS Name: 2,5-dimethoxy-N-[[3-methoxy-4-[2-(2-pyridinyl)ethoxy]phenyl]methyl]-N-[(3S)-2-oxo-3-azepanyl]benzenesulfonamide IUPAC Name: 2,5-dimethoxy-N-[[3-methoxy-4-(2-pyridin-2-ylethoxy)phenyl]methyl]-N-[(3S)-2-oxoazepan-3-yl]benzenesulfonamide Traditional Name: N-[(3S)-2-ketoazepan-3-yl]-2,5-dimethoxy-N-[3-methoxy-4-[2-(2-pyridyl)ethoxy]benzyl]benzenesulfonamide Formula: C29H35N3O7S MolecularWeight: 569.6691

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N(CC2=CC(=C(C=C2)OCCC3=CC=CC=N3)OC)C4CCCCNC4=O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N(CC2=CC(=C(C=C2)OCCC3=CC=CC=N3)OC)[C@H]4CCCCNC4=O

InChI

InChI=1S/C29H35N3O7S/c1-36-23-11-13-26(37-2)28(19-23)40(34,35)32(24-9-5-7-16-31-29(24)33)20-21-10-12-25(27(18-21)38-3)39-17-14-22-8-4-6-15-30-22/h4,6,8,10-13,15,18-19,24H,5,7,9,14,16-17,20H2,1-3H3,(H,31,33)/t24-/m0/s1