2-[2-[methyl-[(5-pyridin-3-ylthiophen-2-yl)methyl]amino]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[methyl-[(5-pyridin-3-ylthiophen-2-yl)methyl]amino]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[methyl-[[5-(3-pyridyl)-2-thienyl]methyl]amino]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[methyl-[[5-(3-pyridinyl)-2-thiophenyl]methyl]amino]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[methyl-[(5-pyridin-3-ylthiophen-2-yl)methyl]amino]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[methyl-[[5-(3-pyridyl)-2-thienyl]methyl]amino]ethyl]isoindoline-1,3-quinone Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCN1C(=O)C2=CC=CC=C2C1=O)CC3=CC=C(S3)C4=CN=CC=C4

Isomeric SMILES

CN(CCN1C(=O)C2=CC=CC=C2C1=O)CC3=CC=C(S3)C4=CN=CC=C4

InChI

InChI=1S/C21H19N3O2S/c1-23(14-16-8-9-19(27-16)15-5-4-10-22-13-15)11-12-24-20(25)17-6-2-3-7-18(17)21(24)26/h2-10,13H,11-12,14H2,1H3