[4-[(Z)-[(4-fluorophenyl)methylcarbamothioylhydrazinylidene]methyl]-2-methoxy-phenyl] cyclopropanecarboxylate

Systemtic Name: [4-[(Z)-[(4-fluorophenyl)methylcarbamothioylhydrazinylidene]methyl]-2-methoxy-phenyl] cyclopropanecarboxylate Openeye Name: [4-[(Z)-[(4-fluorophenyl)methylcarbamothioylhydrazono]methyl]-2-methoxy-phenyl] cyclopropanecarboxylate CAS Name: cyclopropanecarboxylic acid [4-[(Z)-[[[(4-fluorophenyl)methylamino]-sulfanylidenemethyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(Z)-[(4-fluorophenyl)methylcarbamothioylhydrazinylidene]methyl]-2-methoxyphenyl] cyclopropanecarboxylate Traditional Name: cyclopropanecarboxylic acid [4-[(Z)-[(4-fluorobenzyl)thiocarbamoylhydrazono]methyl]-2-methoxy-phenyl] ester Formula: C20H20FN3O3S MolecularWeight: 401.454503

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=S)NCC2=CC=C(C=C2)F)OC(=O)C3CC3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N\NC(=S)NCC2=CC=C(C=C2)F)OC(=O)C3CC3

InChI

InChI=1S/C20H20FN3O3S/c1-26-18-10-14(4-9-17(18)27-19(25)15-5-6-15)12-23-24-20(28)22-11-13-2-7-16(21)8-3-13/h2-4,7-10,12,15H,5-6,11H2,1H3,(H2,22,24,28)/b23-12-