[2-methoxy-4-[(2-methoxyethylcarbamothioylhydrazinylidene)methyl]phenyl] 4-methyl-3-nitro-benzenesulfonate

Systemtic Name: [2-methoxy-4-[(2-methoxyethylcarbamothioylhydrazinylidene)methyl]phenyl] 4-methyl-3-nitro-benzenesulfonate Openeye Name: [2-methoxy-4-[(2-methoxyethylcarbamothioylhydrazono)methyl]phenyl] 4-methyl-3-nitro-benzenesulfonate CAS Name: 4-methyl-3-nitrobenzenesulfonic acid [2-methoxy-4-[[[(2-methoxyethylamino)-sulfanylidenemethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(2-methoxyethylcarbamothioylhydrazinylidene)methyl]phenyl] 4-methyl-3-nitrobenzenesulfonate Traditional Name: 4-methyl-3-nitro-benzenesulfonic acid [2-methoxy-4-[(2-methoxyethylthiocarbamoylhydrazono)methyl]phenyl] ester Formula: C19H22N4O7S2 MolecularWeight: 482.53058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)C=NNC(=S)NCCOC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)C=NNC(=S)NCCOC)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O7S2/c1-13-4-6-15(11-16(13)23(24)25)32(26,27)30-17-7-5-14(10-18(17)29-3)12-21-22-19(31)20-8-9-28-2/h4-7,10-12H,8-9H2,1-3H3,(H2,20,22,31)