2-[2-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)ethyl]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[2-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)ethyl]benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[2-(4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)ethyl]benzo[de]isoquinoline-1,3-dione CAS Name: 2-[2-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)ethyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[2-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)ethyl]benzo[de]isoquinoline-1,3-dione Traditional Name: 2-[2-(4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)ethyl]benzo[de]isoquinoline-1,3-quinone Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=S)CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

Isomeric SMILES

CN1C(=NNC1=S)CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

InChI

InChI=1S/C17H14N4O2S/c1-20-13(18-19-17(20)24)8-9-21-15(22)11-6-2-4-10-5-3-7-12(14(10)11)16(21)23/h2-7H,8-9H2,1H3,(H,19,24)