N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methyl-2-(3-oxidanylidene-1H-isoindol-2-yl)pentanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methyl-2-(3-oxidanylidene-1H-isoindol-2-yl)pentanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methyl-2-(1-oxoisoindolin-2-yl)pentanamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-methyl-2-(3-oxo-1H-isoindol-2-yl)pentanamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methyl-2-(3-oxo-1H-isoindol-2-yl)pentanamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1-ketoisoindolin-2-yl)-4-methyl-valeramide Formula: C26H33N3O4S MolecularWeight: 483.62292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C26H33N3O4S/c1-19(2)17-24(29-18-20-9-5-6-10-23(20)26(29)31)25(30)27-21-11-13-22(14-12-21)34(32,33)28-15-7-3-4-8-16-28/h5-6,9-14,19,24H,3-4,7-8,15-18H2,1-2H3,(H,27,30)