2-cyclopentyl-4-[4-[(E)-3-thiophen-2-ylprop-2-enoyl]piperazin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-cyclopentyl-4-[4-[(E)-3-thiophen-2-ylprop-2-enoyl]piperazin-1-yl]isoindole-1,3-dione Openeye Name: 2-cyclopentyl-4-[4-[(E)-3-(2-thienyl)prop-2-enoyl]piperazin-1-yl]isoindoline-1,3-dione CAS Name: 2-cyclopentyl-4-[4-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]-1-piperazinyl]isoindole-1,3-dione IUPAC Name: 2-cyclopentyl-4-[4-[(E)-3-thiophen-2-ylprop-2-enoyl]piperazin-1-yl]isoindole-1,3-dione Traditional Name: 2-cyclopentyl-4-[4-[(E)-3-(2-thienyl)acryloyl]piperazino]isoindoline-1,3-quinone Formula: C24H25N3O3S MolecularWeight: 435.5386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)C(=O)C=CC5=CC=CS5

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)C(=O)/C=C/C5=CC=CS5

InChI

InChI=1S/C24H25N3O3S/c28-21(11-10-18-7-4-16-31-18)26-14-12-25(13-15-26)20-9-3-8-19-22(20)24(30)27(23(19)29)17-5-1-2-6-17/h3-4,7-11,16-17H,1-2,5-6,12-15H2/b11-10+