2-[2-(3-azanylpyridin-4-yl)sulfanylethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(3-azanylpyridin-4-yl)sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-[(3-amino-4-pyridyl)sulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(3-amino-4-pyridinyl)thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(3-aminopyridin-4-yl)sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(3-amino-4-pyridyl)thio]ethyl]isoindoline-1,3-quinone Formula: C15H13N3O2S MolecularWeight: 299.34762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCSC3=C(C=NC=C3)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCSC3=C(C=NC=C3)N

InChI

InChI=1S/C15H13N3O2S/c16-12-9-17-6-5-13(12)21-8-7-18-14(19)10-3-1-2-4-11(10)15(18)20/h1-6,9H,7-8,16H2