2-[4-[(Z)-N-[(4-fluorophenyl)methylcarbamothioylamino]-C-methyl-carbonimidoyl]-2-methoxy-phenoxy]ethanoate

Systemtic Name: 2-[4-[(Z)-N-[(4-fluorophenyl)methylcarbamothioylamino]-C-methyl-carbonimidoyl]-2-methoxy-phenoxy]ethanoate Openeye Name: 2-[4-[(Z)-N-[(4-fluorophenyl)methylcarbamothioylamino]-C-methyl-carbonimidoyl]-2-methoxy-phenoxy]acetate CAS Name: 2-[4-[(1Z)-1-[[[(4-fluorophenyl)methylamino]-sulfanylidenemethyl]hydrazinylidene]ethyl]-2-methoxyphenoxy]acetate IUPAC Name: 2-[4-[(Z)-N-[(4-fluorophenyl)methylcarbamothioylamino]-C-methylcarbonimidoyl]-2-methoxyphenoxy]acetate Traditional Name: 2-[4-[(Z)-N-[(4-fluorobenzyl)thiocarbamoylamino]-C-methyl-carbonimidoyl]-2-methoxy-phenoxy]acetate Formula: C19H19FN3O4S- MolecularWeight: 404.435263

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC1=CC=C(C=C1)F)C2=CC(=C(C=C2)OCC(=O)[O-])OC

Isomeric SMILES

C/C(=N/NC(=S)NCC1=CC=C(C=C1)F)/C2=CC(=C(C=C2)OCC(=O)[O-])OC

InChI

InChI=1S/C19H20FN3O4S/c1-12(14-5-8-16(17(9-14)26-2)27-11-18(24)25)22-23-19(28)21-10-13-3-6-15(20)7-4-13/h3-9H,10-11H2,1-2H3,(H,24,25)(H2,21,23,28)/p-1/b22-12-