4-[2-[4-(diphenylmethyl)sulfanylpiperidin-1-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 4-[2-[4-(diphenylmethyl)sulfanylpiperidin-1-yl]ethyl]isoindole-1,3-dione Openeye Name: 4-[2-(4-benzhydrylsulfanyl-1-piperidyl)ethyl]isoindoline-1,3-dione CAS Name: 4-[2-[4-[(diphenylmethyl)thio]-1-piperidinyl]ethyl]isoindole-1,3-dione IUPAC Name: 4-[2-(4-benzhydrylsulfanylpiperidin-1-yl)ethyl]isoindole-1,3-dione Traditional Name: 4-[2-[4-(benzhydrylthio)piperidino]ethyl]isoindoline-1,3-quinone Formula: C28H28N2O2S MolecularWeight: 456.59912

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1SC(C2=CC=CC=C2)C3=CC=CC=C3)CCC4=CC=CC5=C4C(=O)NC5=O

Isomeric SMILES

C1CN(CCC1SC(C2=CC=CC=C2)C3=CC=CC=C3)CCC4=CC=CC5=C4C(=O)NC5=O

InChI

InChI=1S/C28H28N2O2S/c31-27-24-13-7-12-20(25(24)28(32)29-27)14-17-30-18-15-23(16-19-30)33-26(21-8-3-1-4-9-21)22-10-5-2-6-11-22/h1-13,23,26H,14-19H2,(H,29,31,32)