S-[3-(phenylcarbonylsulfanyl)quinoxalin-2-yl] benzenecarbothioate

Systemtic Name: S-[3-(phenylcarbonylsulfanyl)quinoxalin-2-yl] benzenecarbothioate Openeye Name: S-(3-benzoylsulfanylquinoxalin-2-yl) benzenecarbothioate CAS Name: benzenecarbothioic acid S-[3-(benzoylthio)-2-quinoxalinyl] ester IUPAC Name: S-(3-benzoylsulfanylquinoxalin-2-yl) benzenecarbothioate Traditional Name: thiobenzoic acid S-[3-(benzoylthio)quinoxalin-2-yl] ester Formula: C22H14N2O2S2 MolecularWeight: 402.48876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SC2=NC3=CC=CC=C3N=C2SC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SC2=NC3=CC=CC=C3N=C2SC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H14N2O2S2/c25-21(15-9-3-1-4-10-15)27-19-20(24-18-14-8-7-13-17(18)23-19)28-22(26)16-11-5-2-6-12-16/h1-14H