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

Systemtic Name: 1-[4-[2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[4-[2-oxo-2-[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]ethyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-2-oxoethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-2-oxoethyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[2-keto-2-(4-tosyl-1,4-diazepan-1-yl)ethyl]phenyl]-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)CC3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)CC3=CC=C(C=C3)N4CCCC4=O

InChI

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