2-methoxy-4-[(Z)-(6-methyl-5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-4-yl)iminomethyl]-6-nitro-phenolate

Systemtic Name: 2-methoxy-4-[(Z)-(6-methyl-5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-4-yl)iminomethyl]-6-nitro-phenolate Openeye Name: 2-methoxy-4-[(Z)-(6-methyl-5-oxo-3-thioxo-2H-1,2,4-triazin-4-yl)iminomethyl]-6-nitro-phenolate CAS Name: 2-methoxy-4-[(Z)-(6-methyl-5-oxo-3-sulfanylidene-2H-1,2,4-triazin-4-yl)iminomethyl]-6-nitrophenolate IUPAC Name: 2-methoxy-4-[(Z)-(6-methyl-5-oxo-3-sulfanylidene-2H-1,2,4-triazin-4-yl)iminomethyl]-6-nitrophenolate Traditional Name: 4-[(Z)-(5-keto-6-methyl-3-thioxo-2H-1,2,4-triazin-4-yl)iminomethyl]-2-methoxy-6-nitro-phenolate Formula: C12H10N5O5S- MolecularWeight: 336.3033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N(C1=O)N=CC2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NNC(=S)N(C1=O)/N=C\C2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H11N5O5S/c1-6-11(19)16(12(23)15-14-6)13-5-7-3-8(17(20)21)10(18)9(4-7)22-2/h3-5,18H,1-2H3,(H,15,23)/p-1/b13-5-