3-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazin-5-olate

Systemtic Name: 3-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazin-5-olate Openeye Name: 3-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazin-5-olate CAS Name: 3-[(4-nitrophenyl)methylthio]-1,2,4-triazin-5-olate IUPAC Name: 3-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazin-5-olate Traditional Name: 3-[(4-nitrobenzyl)thio]-1,2,4-triazin-5-olate Formula: C10H7N4O3S- MolecularWeight: 263.25258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NC(=CN=N2)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CSC2=NC(=CN=N2)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H8N4O3S/c15-9-5-11-13-10(12-9)18-6-7-1-3-8(4-2-7)14(16)17/h1-5H,6H2,(H,12,13,15)/p-1