6-methyl-3-pentylsulfanyl-1,2,4-triazin-5-olate

Systemtic Name: 6-methyl-3-pentylsulfanyl-1,2,4-triazin-5-olate Openeye Name: 6-methyl-3-pentylsulfanyl-1,2,4-triazin-5-olate CAS Name: 6-methyl-3-(pentylthio)-1,2,4-triazin-5-olate IUPAC Name: 6-methyl-3-pentylsulfanyl-1,2,4-triazin-5-olate Traditional Name: 3-(amylthio)-6-methyl-1,2,4-triazin-5-olate Formula: C9H14N3OS- MolecularWeight: 212.29196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NC(=C(N=N1)C)[O-]

Isomeric SMILES

CCCCCSC1=NC(=C(N=N1)C)[O-]

InChI

InChI=1S/C9H15N3OS/c1-3-4-5-6-14-9-10-8(13)7(2)11-12-9/h3-6H2,1-2H3,(H,10,12,13)/p-1