2-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)benzo[de]isoquinoline-1,3-dione CAS Name: 2-[2-(ethylthio)-1,3-benzothiazol-6-yl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)benzo[de]isoquinoline-1,3-dione Traditional Name: 2-[2-(ethylthio)-1,3-benzothiazol-6-yl]benzo[de]isoquinoline-1,3-quinone Formula: C21H14N2O2S2 MolecularWeight: 390.47806

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(S1)C=C(C=C2)N3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O

Isomeric SMILES

CCSC1=NC2=C(S1)C=C(C=C2)N3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O

InChI

InChI=1S/C21H14N2O2S2/c1-2-26-21-22-16-10-9-13(11-17(16)27-21)23-19(24)14-7-3-5-12-6-4-8-15(18(12)14)20(23)25/h3-11H,2H2,1H3