S-(3-pyridin-3-ylcarbonylsulfanylquinoxalin-2-yl) pyridine-3-carbothioate

Systemtic Name: S-(3-pyridin-3-ylcarbonylsulfanylquinoxalin-2-yl) pyridine-3-carbothioate Openeye Name: S-[3-(pyridine-3-carbonylsulfanyl)quinoxalin-2-yl] pyridine-3-carbothioate CAS Name: 3-pyridinecarbothioic acid S-[3-[[oxo(3-pyridinyl)methyl]thio]-2-quinoxalinyl] ester IUPAC Name: S-[3-(pyridine-3-carbonylsulfanyl)quinoxalin-2-yl] pyridine-3-carbothioate Traditional Name: pyridine-3-carbothioic acid S-[3-(nicotinoylthio)quinoxalin-2-yl] ester Formula: C20H12N4O2S2 MolecularWeight: 404.46488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=N2)SC(=O)C3=CN=CC=C3)SC(=O)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)SC(=O)C3=CN=CC=C3)SC(=O)C4=CN=CC=C4

InChI

InChI=1S/C20H12N4O2S2/c25-19(13-5-3-9-21-11-13)27-17-18(24-16-8-2-1-7-15(16)23-17)28-20(26)14-6-4-10-22-12-14/h1-12H