2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)sulfanyl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)sulfanyl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)sulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)sulfanyl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)thio]ethyl]isoindoline-1,3-quinone Formula: C15H14N4O2S MolecularWeight: 314.36226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NC(=N1)SCCN2C(=O)C3=CC=CC=C3C2=O)C

Isomeric SMILES

CC1=C(N=NC(=N1)SCCN2C(=O)C3=CC=CC=C3C2=O)C

InChI

InChI=1S/C15H14N4O2S/c1-9-10(2)17-18-15(16-9)22-8-7-19-13(20)11-5-3-4-6-12(11)14(19)21/h3-6H,7-8H2,1-2H3