3-(2-methylprop-2-enylsulfanyl)-6-phenyl-1,2,4-triazin-5-olate

Systemtic Name: 3-(2-methylprop-2-enylsulfanyl)-6-phenyl-1,2,4-triazin-5-olate Openeye Name: 3-(2-methylallylsulfanyl)-6-phenyl-1,2,4-triazin-5-olate CAS Name: 3-(2-methylprop-2-enylthio)-6-phenyl-1,2,4-triazin-5-olate IUPAC Name: 3-(2-methylprop-2-enylsulfanyl)-6-phenyl-1,2,4-triazin-5-olate Traditional Name: 3-(2-methylallylthio)-6-phenyl-1,2,4-triazin-5-olate Formula: C13H12N3OS- MolecularWeight: 258.31888

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=NC(=C(N=N1)C2=CC=CC=C2)[O-]

Isomeric SMILES

CC(=C)CSC1=NC(=C(N=N1)C2=CC=CC=C2)[O-]

InChI

InChI=1S/C13H13N3OS/c1-9(2)8-18-13-14-12(17)11(15-16-13)10-6-4-3-5-7-10/h3-7H,1,8H2,2H3,(H,14,16,17)/p-1