2-[[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[4-(3-thienylmethyl)piperazin-1-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[4-(3-thiophenylmethyl)-1-piperazinyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[4-(3-thenyl)piperazino]methyl]isoindoline-1,3-quinone Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC=C2)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CCN1CC2=CSC=C2)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C18H19N3O2S/c22-17-15-3-1-2-4-16(15)18(23)21(17)13-20-8-6-19(7-9-20)11-14-5-10-24-12-14/h1-5,10,12H,6-9,11,13H2