4-(4-methylphenyl)sulfonyl-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(4-methylphenyl)sulfonyl-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-1,4-diazepane-1-carboxamide Openeye Name: N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-4-(p-tolylsulfonyl)-1,4-diazepane-1-carboxamide CAS Name: 4-(4-methylphenyl)sulfonyl-N-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]-1,4-diazepane-1-carboxamide IUPAC Name: 4-(4-methylphenyl)sulfonyl-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-1,4-diazepane-1-carboxamide Traditional Name: N-[4-(2-ketopyrrolidino)benzyl]-4-tosyl-1,4-diazepane-1-carboxamide Formula: C24H30N4O4S MolecularWeight: 470.5844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)NCC3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)NCC3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C24H30N4O4S/c1-19-5-11-22(12-6-19)33(31,32)27-14-3-13-26(16-17-27)24(30)25-18-20-7-9-21(10-8-20)28-15-2-4-23(28)29/h5-12H,2-4,13-18H2,1H3,(H,25,30)