3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]propanamide

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]propanamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]propanamide CAS Name: 3-[4-(1-azepanylsulfonyl)phenyl]-N-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]propanamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]propanamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[4-(2-ketopyrrolidino)benzyl]propionamide Formula: C26H33N3O4S MolecularWeight: 483.62292

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C26H33N3O4S/c30-25(27-20-22-7-12-23(13-8-22)29-19-5-6-26(29)31)16-11-21-9-14-24(15-10-21)34(32,33)28-17-3-1-2-4-18-28/h7-10,12-15H,1-6,11,16-20H2,(H,27,30)