6-(2-azanyl-5-bromanyl-phenyl)-3-prop-2-enylsulfanyl-1,2,4-triazin-5-olate

Systemtic Name: 6-(2-azanyl-5-bromanyl-phenyl)-3-prop-2-enylsulfanyl-1,2,4-triazin-5-olate Openeye Name: 3-allylsulfanyl-6-(2-amino-5-bromo-phenyl)-1,2,4-triazin-5-olate CAS Name: 6-(2-amino-5-bromophenyl)-3-(prop-2-enylthio)-1,2,4-triazin-5-olate IUPAC Name: 6-(2-amino-5-bromophenyl)-3-prop-2-enylsulfanyl-1,2,4-triazin-5-olate Traditional Name: 3-(allylthio)-6-(2-amino-5-bromo-phenyl)-1,2,4-triazin-5-olate Formula: C12H10BrN4OS- MolecularWeight: 338.203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11BrN4OS/c1-2-5-19-12-15-11(18)10(16-17-12)8-6-7(13)3-4-9(8)14/h2-4,6H,1,5,14H2,(H,15,17,18)/p-1