4-[4-(2,2-dimethylpropyl)piperazin-1-yl]-2-(1-thiophen-2-ylethyl)isoindole-1,3-dione

Systemtic Name: 4-[4-(2,2-dimethylpropyl)piperazin-1-yl]-2-(1-thiophen-2-ylethyl)isoindole-1,3-dione Openeye Name: 4-[4-(2,2-dimethylpropyl)piperazin-1-yl]-2-[1-(2-thienyl)ethyl]isoindoline-1,3-dione CAS Name: 4-[4-(2,2-dimethylpropyl)-1-piperazinyl]-2-(1-thiophen-2-ylethyl)isoindole-1,3-dione IUPAC Name: 4-[4-(2,2-dimethylpropyl)piperazin-1-yl]-2-(1-thiophen-2-ylethyl)isoindole-1,3-dione Traditional Name: 4-(4-neopentylpiperazino)-2-[1-(2-thienyl)ethyl]isoindoline-1,3-quinone Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)N2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)CC(C)(C)C

Isomeric SMILES

CC(C1=CC=CS1)N2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)CC(C)(C)C

InChI

InChI=1S/C23H29N3O2S/c1-16(19-9-6-14-29-19)26-21(27)17-7-5-8-18(20(17)22(26)28)25-12-10-24(11-13-25)15-23(2,3)4/h5-9,14,16H,10-13,15H2,1-4H3