2-(2,4-dinitrophenyl)-3-methylsulfanyl-1H-1,2,4-triazol-5-one

Systemtic Name: 2-(2,4-dinitrophenyl)-3-methylsulfanyl-1H-1,2,4-triazol-5-one Openeye Name: 2-(2,4-dinitrophenyl)-3-methylsulfanyl-1H-1,2,4-triazol-5-one CAS Name: 2-(2,4-dinitrophenyl)-3-(methylthio)-1H-1,2,4-triazol-5-one IUPAC Name: 2-(2,4-dinitrophenyl)-3-methylsulfanyl-1H-1,2,4-triazol-5-one Traditional Name: 2-(2,4-dinitrophenyl)-3-(methylthio)-1H-1,2,4-triazol-5-one Formula: C9H7N5O5S MolecularWeight: 297.24738

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=O)NN1C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CSC1=NC(=O)NN1C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H7N5O5S/c1-20-9-10-8(15)11-12(9)6-3-2-5(13(16)17)4-7(6)14(18)19/h2-4H,1H3,(H,11,15)