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

Systemtic Name: 2-[2-[(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)sulfanyl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanyl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(5-keto-6-methyl-2H-1,2,4-triazin-3-yl)thio]ethyl]isoindoline-1,3-quinone Formula: C14H12N4O3S MolecularWeight: 316.33508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)SCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=NNC(=NC1=O)SCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C14H12N4O3S/c1-8-11(19)15-14(17-16-8)22-7-6-18-12(20)9-4-2-3-5-10(9)13(18)21/h2-5H,6-7H2,1H3,(H,15,17,19)