2-(1-benzothiophen-2-ylmethyl)-4-(4-piperidin-1-ylcarbonylpiperidin-1-yl)isoindole-1,3-dione

Systemtic Name: 2-(1-benzothiophen-2-ylmethyl)-4-(4-piperidin-1-ylcarbonylpiperidin-1-yl)isoindole-1,3-dione Openeye Name: 2-(benzothiophen-2-ylmethyl)-4-[4-(piperidine-1-carbonyl)-1-piperidyl]isoindoline-1,3-dione CAS Name: 2-(1-benzothiophen-2-ylmethyl)-4-[4-[oxo(1-piperidinyl)methyl]-1-piperidinyl]isoindole-1,3-dione IUPAC Name: 2-(1-benzothiophen-2-ylmethyl)-4-[4-(piperidine-1-carbonyl)piperidin-1-yl]isoindole-1,3-dione Traditional Name: 2-(benzothiophen-2-ylmethyl)-4-[4-(piperidine-1-carbonyl)piperidino]isoindoline-1,3-quinone Formula: C28H29N3O3S MolecularWeight: 487.61316

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CC5=CC6=CC=CC=C6S5

Isomeric SMILES

C1CCN(CC1)C(=O)C2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CC5=CC6=CC=CC=C6S5

InChI

InChI=1S/C28H29N3O3S/c32-26(30-13-4-1-5-14-30)19-11-15-29(16-12-19)23-9-6-8-22-25(23)28(34)31(27(22)33)18-21-17-20-7-2-3-10-24(20)35-21/h2-3,6-10,17,19H,1,4-5,11-16,18H2