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

Systemtic Name: 2-[4-[(Z)-N-[(4-fluorophenyl)carbamothioylamino]-C-methyl-carbonimidoyl]phenoxy]ethanoate Openeye Name: 2-[4-[(Z)-N-[(4-fluorophenyl)carbamothioylamino]-C-methyl-carbonimidoyl]phenoxy]acetate CAS Name: 2-[4-[(1Z)-1-[[(4-fluoroanilino)-sulfanylidenemethyl]hydrazinylidene]ethyl]phenoxy]acetate IUPAC Name: 2-[4-[(Z)-N-[(4-fluorophenyl)carbamothioylamino]-C-methylcarbonimidoyl]phenoxy]acetate Traditional Name: 2-[4-[(Z)-N-[(4-fluorophenyl)thiocarbamoylamino]-C-methyl-carbonimidoyl]phenoxy]acetate Formula: C17H15FN3O3S- MolecularWeight: 360.382703

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC1=CC=C(C=C1)F)C2=CC=C(C=C2)OCC(=O)[O-]

Isomeric SMILES

C/C(=N/NC(=S)NC1=CC=C(C=C1)F)/C2=CC=C(C=C2)OCC(=O)[O-]

InChI

InChI=1S/C17H16FN3O3S/c1-11(12-2-8-15(9-3-12)24-10-16(22)23)20-21-17(25)19-14-6-4-13(18)5-7-14/h2-9H,10H2,1H3,(H,22,23)(H2,19,21,25)/p-1/b20-11-