1-[5-chloranyl-2-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]phenyl]pyrrolidin-2-one

Systemtic Name: 1-[5-chloranyl-2-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[5-chloro-2-[4-(p-tolylsulfonyl)-1,4-diazepane-1-carbonyl]phenyl]pyrrolidin-2-one CAS Name: 1-[5-chloro-2-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-oxomethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[5-chloro-2-[4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carbonyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[5-chloro-2-(4-tosyl-1,4-diazepane-1-carbonyl)phenyl]-2-pyrrolidone Formula: C23H26ClN3O4S MolecularWeight: 475.98824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26ClN3O4S/c1-17-5-8-19(9-6-17)32(30,31)26-12-3-11-25(14-15-26)23(29)20-10-7-18(24)16-21(20)27-13-2-4-22(27)28/h5-10,16H,2-4,11-15H2,1H3