6-(2-aminophenyl)-3-(phenylmethylsulfanyl)-1,2,4-triazin-5-olate

Systemtic Name: 6-(2-aminophenyl)-3-(phenylmethylsulfanyl)-1,2,4-triazin-5-olate Openeye Name: 6-(2-aminophenyl)-3-benzylsulfanyl-1,2,4-triazin-5-olate CAS Name: 6-(2-aminophenyl)-3-(phenylmethylthio)-1,2,4-triazin-5-olate IUPAC Name: 6-(2-aminophenyl)-3-benzylsulfanyl-1,2,4-triazin-5-olate Traditional Name: 6-(2-aminophenyl)-3-(benzylthio)-1,2,4-triazin-5-olate Formula: C16H13N4OS- MolecularWeight: 309.36562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=C(N=N2)C3=CC=CC=C3N)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=C(N=N2)C3=CC=CC=C3N)[O-]

InChI

InChI=1S/C16H14N4OS/c17-13-9-5-4-8-12(13)14-15(21)18-16(20-19-14)22-10-11-6-2-1-3-7-11/h1-9H,10,17H2,(H,18,20,21)/p-1