2-[2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]ethyl]isoindoline-1,3-quinone Formula: C15H14N4O2S MolecularWeight: 314.36226

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=NN=C2SCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CC1N2C=NN=C2SCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C15H14N4O2S/c20-13-11-3-1-2-4-12(11)14(21)18(13)7-8-22-15-17-16-9-19(15)10-5-6-10/h1-4,9-10H,5-8H2