methyl 2-[(Z)-[(4-fluorophenyl)carbamothioylhydrazinylidene]methyl]benzoate

Systemtic Name: methyl 2-[(Z)-[(4-fluorophenyl)carbamothioylhydrazinylidene]methyl]benzoate Openeye Name: methyl 2-[(Z)-[(4-fluorophenyl)carbamothioylhydrazono]methyl]benzoate CAS Name: 2-[(Z)-[[(4-fluoroanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(Z)-[(4-fluorophenyl)carbamothioylhydrazinylidene]methyl]benzoate Traditional Name: 2-[(Z)-[(4-fluorophenyl)thiocarbamoylhydrazono]methyl]benzoic acid methyl ester Formula: C16H14FN3O2S MolecularWeight: 331.364663

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C=NNC(=S)NC2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)C1=CC=CC=C1/C=N\NC(=S)NC2=CC=C(C=C2)F

InChI

InChI=1S/C16H14FN3O2S/c1-22-15(21)14-5-3-2-4-11(14)10-18-20-16(23)19-13-8-6-12(17)7-9-13/h2-10H,1H3,(H2,19,20,23)/b18-10-