1-[[4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]phenyl]methyl]pyrrolidin-2-one

Systemtic Name: 1-[[4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]phenyl]methyl]pyrrolidin-2-one Openeye Name: 1-[[4-[4-(p-tolylsulfonyl)-1,4-diazepane-1-carbonyl]phenyl]methyl]pyrrolidin-2-one CAS Name: 1-[[4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-oxomethyl]phenyl]methyl]-2-pyrrolidinone IUPAC Name: 1-[[4-[4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carbonyl]phenyl]methyl]pyrrolidin-2-one Traditional Name: 1-[4-(4-tosyl-1,4-diazepane-1-carbonyl)benzyl]-2-pyrrolidone Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C3=CC=C(C=C3)CN4CCCC4=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C3=CC=C(C=C3)CN4CCCC4=O

InChI

InChI=1S/C24H29N3O4S/c1-19-5-11-22(12-6-19)32(30,31)27-15-3-14-25(16-17-27)24(29)21-9-7-20(8-10-21)18-26-13-2-4-23(26)28/h5-12H,2-4,13-18H2,1H3