3-bromanyl-8-methylsulfanyl-5-oxidanidyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium

Systemtic Name: 3-bromanyl-8-methylsulfanyl-5-oxidanidyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Openeye Name: 3-bromo-8-methylsulfanyl-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium CAS Name: 3-bromo-8-(methylthio)-5-oxidopyrazolo[5,1-c][1,2,4]benzotriazin-5-ium IUPAC Name: 3-bromo-8-methylsulfanyl-5-oxidopyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Traditional Name: 3-bromo-8-(methylthio)-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Formula: C10H7BrN4OS MolecularWeight: 311.15778

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)[N+](=NC3=C(C=NN23)Br)[O-]

Isomeric SMILES

CSC1=CC2=C(C=C1)[N+](=NC3=C(C=NN23)Br)[O-]

InChI

InChI=1S/C10H7BrN4OS/c1-17-6-2-3-8-9(4-6)14-10(13-15(8)16)7(11)5-12-14/h2-5H,1H3