3-[6-[(3,5-ditert-butylphenyl)methylamino]hexylsulfanyl]-1-naphthalen-1-yl-pyrrolidine-2,5-dione

Systemtic Name: 3-[6-[(3,5-ditert-butylphenyl)methylamino]hexylsulfanyl]-1-naphthalen-1-yl-pyrrolidine-2,5-dione Openeye Name: 3-[6-[(3,5-ditert-butylphenyl)methylamino]hexylsulfanyl]-1-(1-naphthyl)pyrrolidine-2,5-dione CAS Name: 3-[6-[(3,5-ditert-butylphenyl)methylamino]hexylthio]-1-(1-naphthalenyl)pyrrolidine-2,5-dione IUPAC Name: 3-[6-[(3,5-ditert-butylphenyl)methylamino]hexylsulfanyl]-1-naphthalen-1-ylpyrrolidine-2,5-dione Traditional Name: 3-[6-[(3,5-ditert-butylbenzyl)amino]hexylthio]-1-(1-naphthyl)pyrrolidine-2,5-quinone Formula: C35H46N2O2S MolecularWeight: 558.81694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)CNCCCCCCSC2CC(=O)N(C2=O)C3=CC=CC4=CC=CC=C43)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)CNCCCCCCSC2CC(=O)N(C2=O)C3=CC=CC4=CC=CC=C43)C(C)(C)C

InChI

InChI=1S/C35H46N2O2S/c1-34(2,3)27-20-25(21-28(22-27)35(4,5)6)24-36-18-11-7-8-12-19-40-31-23-32(38)37(33(31)39)30-17-13-15-26-14-9-10-16-29(26)30/h9-10,13-17,20-22,31,36H,7-8,11-12,18-19,23-24H2,1-6H3