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

Systemtic Name: 4-azanyl-2-[[4-(thiophen-2-ylmethyl)piperazin-1-yl]methyl]isoindole-1,3-dione Openeye Name: 4-amino-2-[[4-(2-thienylmethyl)piperazin-1-yl]methyl]isoindoline-1,3-dione CAS Name: 4-amino-2-[[4-(thiophen-2-ylmethyl)-1-piperazinyl]methyl]isoindole-1,3-dione IUPAC Name: 4-amino-2-[[4-(thiophen-2-ylmethyl)piperazin-1-yl]methyl]isoindole-1,3-dione Traditional Name: 4-amino-2-[[4-(2-thenyl)piperazino]methyl]isoindoline-1,3-quinone Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CS2)CN3C(=O)C4=C(C3=O)C(=CC=C4)N

Isomeric SMILES

C1CN(CCN1CC2=CC=CS2)CN3C(=O)C4=C(C3=O)C(=CC=C4)N

InChI

InChI=1S/C18H20N4O2S/c19-15-5-1-4-14-16(15)18(24)22(17(14)23)12-21-8-6-20(7-9-21)11-13-3-2-10-25-13/h1-5,10H,6-9,11-12,19H2