2-[5-[(Z)-N-[(4-fluorophenyl)methylcarbamothioylamino]-C-methyl-carbonimidoyl]-2-methoxy-phenyl]ethanoate

Systemtic Name: 2-[5-[(Z)-N-[(4-fluorophenyl)methylcarbamothioylamino]-C-methyl-carbonimidoyl]-2-methoxy-phenyl]ethanoate Openeye Name: 2-[5-[(Z)-N-[(4-fluorophenyl)methylcarbamothioylamino]-C-methyl-carbonimidoyl]-2-methoxy-phenyl]acetate CAS Name: 2-[5-[(1Z)-1-[[[(4-fluorophenyl)methylamino]-sulfanylidenemethyl]hydrazinylidene]ethyl]-2-methoxyphenyl]acetate IUPAC Name: 2-[5-[(Z)-N-[(4-fluorophenyl)methylcarbamothioylamino]-C-methylcarbonimidoyl]-2-methoxyphenyl]acetate Traditional Name: 2-[5-[(Z)-N-[(4-fluorobenzyl)thiocarbamoylamino]-C-methyl-carbonimidoyl]-2-methoxy-phenyl]acetate Formula: C19H19FN3O3S- MolecularWeight: 388.435863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20FN3O3S/c1-12(14-5-8-17(26-2)15(9-14)10-18(24)25)22-23-19(27)21-11-13-3-6-16(20)7-4-13/h3-9H,10-11H2,1-2H3,(H,24,25)(H2,21,23,27)/p-1/b22-12-