2-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)ethyl]isoindoline-1,3-dione CAS Name: 2-[2-(4H-3,1-benzothiazin-2-ylthio)ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-(4H-3,1-benzothiazin-2-ylthio)ethyl]isoindoline-1,3-quinone Formula: C18H14N2O2S2 MolecularWeight: 354.44596

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2N=C(S1)SCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1C2=CC=CC=C2N=C(S1)SCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C18H14N2O2S2/c21-16-13-6-2-3-7-14(13)17(22)20(16)9-10-23-18-19-15-8-4-1-5-12(15)11-24-18/h1-8H,9-11H2