[4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-methoxy-phenyl] 4-fluoranylbenzenesulfonate

Systemtic Name: [4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-methoxy-phenyl] 4-fluoranylbenzenesulfonate Openeye Name: [4-[(E)-(carbamothioylhydrazono)methyl]-2-methoxy-phenyl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-methoxyphenyl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [2-methoxy-4-[(E)-(thiocarbamoylhydrazono)methyl]phenyl] ester Formula: C15H14FN3O4S2 MolecularWeight: 383.417763

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=S)N)OS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=S)N)OS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C15H14FN3O4S2/c1-22-14-8-10(9-18-19-15(17)24)2-7-13(14)23-25(20,21)12-5-3-11(16)4-6-12/h2-9H,1H3,(H3,17,19,24)/b18-9+