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

Systemtic Name: 2-[2-[4-(diphenylmethyl)sulfanylpiperidin-1-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(4-benzhydrylsulfanyl-1-piperidyl)ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[4-[(diphenylmethyl)thio]-1-piperidinyl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4-benzhydrylsulfanylpiperidin-1-yl)ethyl]isoindole-1,3-dione Traditional Name: 2-[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)CCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCC1SC(C2=CC=CC=C2)C3=CC=CC=C3)CCN4C(=O)C5=CC=CC=C5C4=O

InChI

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