[2-[(E)-[(5-ethyl-4-oxidanylidene-1,3-thiazol-2-yl)hydrazinylidene]methyl]-4-methyl-phenyl] 4-methyl-3-nitro-benzenesulfonate

Systemtic Name: [2-[(E)-[(5-ethyl-4-oxidanylidene-1,3-thiazol-2-yl)hydrazinylidene]methyl]-4-methyl-phenyl] 4-methyl-3-nitro-benzenesulfonate Openeye Name: [2-[(E)-[(5-ethyl-4-oxo-thiazol-2-yl)hydrazono]methyl]-4-methyl-phenyl] 4-methyl-3-nitro-benzenesulfonate CAS Name: 4-methyl-3-nitrobenzenesulfonic acid [2-[(E)-[(5-ethyl-4-oxo-2-thiazolyl)hydrazinylidene]methyl]-4-methylphenyl] ester IUPAC Name: [2-[(E)-[(5-ethyl-4-oxo-1,3-thiazol-2-yl)hydrazinylidene]methyl]-4-methylphenyl] 4-methyl-3-nitrobenzenesulfonate Traditional Name: 4-methyl-3-nitro-benzenesulfonic acid [2-[(E)-[(5-ethyl-4-keto-2-thiazolin-2-yl)hydrazono]methyl]-4-methyl-phenyl] ester Formula: C20H20N4O6S2 MolecularWeight: 476.526

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N=C(S1)NN=CC2=C(C=CC(=C2)C)OS(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCC1C(=O)N=C(S1)N/N=C/C2=C(C=CC(=C2)C)OS(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O6S2/c1-4-18-19(25)22-20(31-18)23-21-11-14-9-12(2)5-8-17(14)30-32(28,29)15-7-6-13(3)16(10-15)24(26)27/h5-11,18H,4H2,1-3H3,(H,22,23,25)/b21-11+