3-heptylsulfanyl-6-methyl-2H-1,2,4-triazin-5-one

Systemtic Name: 3-heptylsulfanyl-6-methyl-2H-1,2,4-triazin-5-one Openeye Name: 3-heptylsulfanyl-6-methyl-2H-1,2,4-triazin-5-one CAS Name: 3-(heptylthio)-6-methyl-2H-1,2,4-triazin-5-one IUPAC Name: 3-heptylsulfanyl-6-methyl-2H-1,2,4-triazin-5-one Traditional Name: 3-(heptylthio)-6-methyl-2H-1,2,4-triazin-5-one Formula: C11H19N3OS MolecularWeight: 241.35306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=NC(=O)C(=NN1)C

Isomeric SMILES

CCCCCCCSC1=NC(=O)C(=NN1)C

InChI

InChI=1S/C11H19N3OS/c1-3-4-5-6-7-8-16-11-12-10(15)9(2)13-14-11/h3-8H2,1-2H3,(H,12,14,15)