4-[(Z)-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2-nitro-phenolate

Systemtic Name: 4-[(Z)-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2-nitro-phenolate Openeye Name: 4-[(Z)-(3-methyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]-2-nitro-phenolate CAS Name: 4-[(Z)-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2-nitrophenolate IUPAC Name: 4-[(Z)-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2-nitrophenolate Traditional Name: 4-[(Z)-(3-methyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]-2-nitro-phenolate Formula: C10H8N5O3S- MolecularWeight: 278.26722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1N=CC2=CC(=C(C=C2)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NNC(=S)N1/N=C\C2=CC(=C(C=C2)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H9N5O3S/c1-6-12-13-10(19)14(6)11-5-7-2-3-9(16)8(4-7)15(17)18/h2-5,16H,1H3,(H,13,19)/p-1/b11-5-