4-[(Z)-(3-ethoxy-5-nitro-4-oxidanidyl-phenyl)methylideneamino]-6-methyl-3-sulfanylidene-1,2,4-triazin-5-olate

Systemtic Name: 4-[(Z)-(3-ethoxy-5-nitro-4-oxidanidyl-phenyl)methylideneamino]-6-methyl-3-sulfanylidene-1,2,4-triazin-5-olate Openeye Name: 4-[(Z)-(3-ethoxy-5-nitro-4-oxido-phenyl)methyleneamino]-6-methyl-3-thioxo-1,2,4-triazin-5-olate CAS Name: 4-[(Z)-(3-ethoxy-5-nitro-4-oxidophenyl)methylideneamino]-6-methyl-3-sulfanylidene-1,2,4-triazin-5-olate IUPAC Name: 4-[(Z)-(3-ethoxy-5-nitro-4-oxidophenyl)methylideneamino]-6-methyl-3-sulfanylidene-1,2,4-triazin-5-olate Traditional Name: 4-[(Z)-(3-ethoxy-5-nitro-4-oxido-benzylidene)amino]-6-methyl-3-thioxo-1,2,4-triazin-5-olate Formula: C13H11N5O5S-2 MolecularWeight: 349.32194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=NN2C(=C(N=NC2=S)C)[O-]

Isomeric SMILES

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=N\N2C(=C(N=NC2=S)C)[O-]

InChI

InChI=1S/C13H13N5O5S/c1-3-23-10-5-8(4-9(11(10)19)18(21)22)6-14-17-12(20)7(2)15-16-13(17)24/h4-6,19-20H,3H2,1-2H3/p-2/b14-6-