6-heptylsulfanyl-2H-1,2,4-triazine-3,5-dione

Systemtic Name: 6-heptylsulfanyl-2H-1,2,4-triazine-3,5-dione Openeye Name: 6-heptylsulfanyl-2H-1,2,4-triazine-3,5-dione CAS Name: 6-(heptylthio)-2H-1,2,4-triazine-3,5-dione IUPAC Name: 6-heptylsulfanyl-2H-1,2,4-triazine-3,5-dione Traditional Name: 6-(heptylthio)-2H-1,2,4-triazine-3,5-quinone Formula: C10H17N3O2S MolecularWeight: 243.32588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=NNC(=O)NC1=O

Isomeric SMILES

CCCCCCCSC1=NNC(=O)NC1=O

InChI

InChI=1S/C10H17N3O2S/c1-2-3-4-5-6-7-16-9-8(14)11-10(15)13-12-9/h2-7H2,1H3,(H2,11,13,14,15)