3-ethylsulfanyl-6-[(4-hydroxyphenyl)methyl]-1,2,4-triazin-5-olate

Systemtic Name: 3-ethylsulfanyl-6-[(4-hydroxyphenyl)methyl]-1,2,4-triazin-5-olate Openeye Name: 3-ethylsulfanyl-6-[(4-hydroxyphenyl)methyl]-1,2,4-triazin-5-olate CAS Name: 3-(ethylthio)-6-[(4-hydroxyphenyl)methyl]-1,2,4-triazin-5-olate IUPAC Name: 3-ethylsulfanyl-6-[(4-hydroxyphenyl)methyl]-1,2,4-triazin-5-olate Traditional Name: 3-(ethylthio)-6-(4-hydroxybenzyl)-1,2,4-triazin-5-olate Formula: C12H12N3O2S- MolecularWeight: 262.30758

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=C(N=N1)CC2=CC=C(C=C2)O)[O-]

Isomeric SMILES

CCSC1=NC(=C(N=N1)CC2=CC=C(C=C2)O)[O-]

InChI

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