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

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]propanamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[3-(2-oxopyrrolidin-1-yl)phenyl]propanamide CAS Name: 3-[4-(1-azepanylsulfonyl)phenyl]-N-[3-(2-oxo-1-pyrrolidinyl)phenyl]propanamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[3-(2-oxopyrrolidin-1-yl)phenyl]propanamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[3-(2-ketopyrrolidino)phenyl]propionamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC=CC(=C3)N4CCCC4=O

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC=CC(=C3)N4CCCC4=O

InChI

InChI=1S/C25H31N3O4S/c29-24(26-21-7-5-8-22(19-21)28-18-6-9-25(28)30)15-12-20-10-13-23(14-11-20)33(31,32)27-16-3-1-2-4-17-27/h5,7-8,10-11,13-14,19H,1-4,6,9,12,15-18H2,(H,26,29)