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

Systemtic Name: 3-[(4-tert-butylphenyl)methylsulfanyl]-6-methyl-1,2,4-triazin-5-olate Openeye Name: 3-[(4-tert-butylphenyl)methylsulfanyl]-6-methyl-1,2,4-triazin-5-olate CAS Name: 3-[(4-tert-butylphenyl)methylthio]-6-methyl-1,2,4-triazin-5-olate IUPAC Name: 3-[(4-tert-butylphenyl)methylsulfanyl]-6-methyl-1,2,4-triazin-5-olate Traditional Name: 3-[(4-tert-butylbenzyl)thio]-6-methyl-1,2,4-triazin-5-olate Formula: C15H18N3OS- MolecularWeight: 288.38792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=N1)SCC2=CC=C(C=C2)C(C)(C)C)[O-]

Isomeric SMILES

CC1=C(N=C(N=N1)SCC2=CC=C(C=C2)C(C)(C)C)[O-]

InChI

InChI=1S/C15H19N3OS/c1-10-13(19)16-14(18-17-10)20-9-11-5-7-12(8-6-11)15(2,3)4/h5-8H,9H2,1-4H3,(H,16,18,19)/p-1