2-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)isoindole-1,3-dione

Systemtic Name: 2-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)isoindole-1,3-dione Openeye Name: 2-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)isoindoline-1,3-dione CAS Name: 2-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]isoindole-1,3-dione IUPAC Name: 2-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)isoindole-1,3-dione Traditional Name: 2-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]isoindoline-1,3-quinone Formula: C12H9N3O2S2 MolecularWeight: 291.34876

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCSC1=NN=C(S1)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C12H9N3O2S2/c1-2-18-12-14-13-11(19-12)15-9(16)7-5-3-4-6-8(7)10(15)17/h3-6H,2H2,1H3