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

Systemtic Name: 2-(5-propyl-1,3,4-thiadiazol-2-yl)isoindole-1,3-dione Openeye Name: 2-(5-propyl-1,3,4-thiadiazol-2-yl)isoindoline-1,3-dione CAS Name: 2-(5-propyl-1,3,4-thiadiazol-2-yl)isoindole-1,3-dione IUPAC Name: 2-(5-propyl-1,3,4-thiadiazol-2-yl)isoindole-1,3-dione Traditional Name: 2-(5-propyl-1,3,4-thiadiazol-2-yl)isoindoline-1,3-quinone Formula: C13H11N3O2S MolecularWeight: 273.31034

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCC1=NN=C(S1)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C13H11N3O2S/c1-2-5-10-14-15-13(19-10)16-11(17)8-6-3-4-7-9(8)12(16)18/h3-4,6-7H,2,5H2,1H3