[2-methoxy-4-[(E)-(methylcarbamothioylhydrazinylidene)methyl]phenyl] naphthalene-1-sulfonate

Systemtic Name: [2-methoxy-4-[(E)-(methylcarbamothioylhydrazinylidene)methyl]phenyl] naphthalene-1-sulfonate Openeye Name: [2-methoxy-4-[(E)-(methylcarbamothioylhydrazono)methyl]phenyl] naphthalene-1-sulfonate CAS Name: 1-naphthalenesulfonic acid [2-methoxy-4-[(E)-[[methylamino(sulfanylidene)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-(methylcarbamothioylhydrazinylidene)methyl]phenyl] naphthalene-1-sulfonate Traditional Name: naphthalene-1-sulfonic acid [2-methoxy-4-[(E)-(methylthiocarbamoylhydrazono)methyl]phenyl] ester Formula: C20H19N3O4S2 MolecularWeight: 429.51256

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NN=CC1=CC(=C(C=C1)OS(=O)(=O)C2=CC=CC3=CC=CC=C32)OC

Isomeric SMILES

CNC(=S)N/N=C/C1=CC(=C(C=C1)OS(=O)(=O)C2=CC=CC3=CC=CC=C32)OC

InChI

InChI=1S/C20H19N3O4S2/c1-21-20(28)23-22-13-14-10-11-17(18(12-14)26-2)27-29(24,25)19-9-5-7-15-6-3-4-8-16(15)19/h3-13H,1-2H3,(H2,21,23,28)/b22-13+