[2-methoxy-4-[[(phenylmethyl)carbamothioylhydrazinylidene]methyl]phenyl] 2,5-dimethylbenzenesulfonate

Systemtic Name: [2-methoxy-4-[[(phenylmethyl)carbamothioylhydrazinylidene]methyl]phenyl] 2,5-dimethylbenzenesulfonate Openeye Name: [4-[(benzylcarbamothioylhydrazono)methyl]-2-methoxy-phenyl] 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid [2-methoxy-4-[[[[(phenylmethyl)amino]-sulfanylidenemethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(benzylcarbamothioylhydrazinylidene)methyl]-2-methoxyphenyl] 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid [4-[(benzylthiocarbamoylhydrazono)methyl]-2-methoxy-phenyl] ester Formula: C24H25N3O4S2 MolecularWeight: 483.603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=C(C=C(C=C2)C=NNC(=S)NCC3=CC=CC=C3)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=C(C=C(C=C2)C=NNC(=S)NCC3=CC=CC=C3)OC

InChI

InChI=1S/C24H25N3O4S2/c1-17-9-10-18(2)23(13-17)33(28,29)31-21-12-11-20(14-22(21)30-3)16-26-27-24(32)25-15-19-7-5-4-6-8-19/h4-14,16H,15H2,1-3H3,(H2,25,27,32)