6-[(4-methoxyphenyl)methyl]-3-methylsulfanyl-1,2,4-triazin-5-olate

Systemtic Name: 6-[(4-methoxyphenyl)methyl]-3-methylsulfanyl-1,2,4-triazin-5-olate Openeye Name: 6-[(4-methoxyphenyl)methyl]-3-methylsulfanyl-1,2,4-triazin-5-olate CAS Name: 6-[(4-methoxyphenyl)methyl]-3-(methylthio)-1,2,4-triazin-5-olate IUPAC Name: 6-[(4-methoxyphenyl)methyl]-3-methylsulfanyl-1,2,4-triazin-5-olate Traditional Name: 3-(methylthio)-6-p-anisyl-1,2,4-triazin-5-olate Formula: C12H12N3O2S- MolecularWeight: 262.30758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=C(N=C(N=N2)SC)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CC2=C(N=C(N=N2)SC)[O-]

InChI

InChI=1S/C12H13N3O2S/c1-17-9-5-3-8(4-6-9)7-10-11(16)13-12(18-2)15-14-10/h3-6H,7H2,1-2H3,(H,13,15,16)/p-1