2-[(6-azanylpyridin-3-yl)sulfanylmethyl]isoindole-1,3-dione

Systemtic Name: 2-[(6-azanylpyridin-3-yl)sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[(6-amino-3-pyridyl)sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[(6-amino-3-pyridinyl)thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[(6-aminopyridin-3-yl)sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[(6-amino-3-pyridyl)thio]methyl]isoindoline-1,3-quinone Formula: C14H11N3O2S MolecularWeight: 285.32104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CSC3=CN=C(C=C3)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CSC3=CN=C(C=C3)N

InChI

InChI=1S/C14H11N3O2S/c15-12-6-5-9(7-16-12)20-8-17-13(18)10-3-1-2-4-11(10)14(17)19/h1-7H,8H2,(H2,15,16)