2-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]ethyl]isoindoline-1,3-quinone Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C18H18N4O2S/c23-16-13-3-1-2-4-14(13)17(24)21(16)9-10-25-18-20-19-15(11-5-6-11)22(18)12-7-8-12/h1-4,11-12H,5-10H2