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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC2=CC=C(C=C2)N3CCCC3=O)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CC2=CC=C(C=C2)N3CCCC3=O)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H31N3O4S/c1-19-8-11-21(18-23(19)33(31,32)27-14-4-2-3-5-15-27)26-24(29)17-20-9-12-22(13-10-20)28-16-6-7-25(28)30/h8-13,18H,2-7,14-17H2,1H3,(H,26,29)