2-[4-[(Z)-C-ethyl-N-[(phenylmethyl)carbamothioylamino]carbonimidoyl]phenoxy]ethanoate

Systemtic Name: 2-[4-[(Z)-C-ethyl-N-[(phenylmethyl)carbamothioylamino]carbonimidoyl]phenoxy]ethanoate Openeye Name: 2-[4-[(Z)-N-(benzylcarbamothioylamino)-C-ethyl-carbonimidoyl]phenoxy]acetate CAS Name: 2-[4-[(1Z)-1-[[[(phenylmethyl)amino]-sulfanylidenemethyl]hydrazinylidene]propyl]phenoxy]acetate IUPAC Name: 2-[4-[(Z)-N-(benzylcarbamothioylamino)-C-ethylcarbonimidoyl]phenoxy]acetate Traditional Name: 2-[4-[(Z)-N-(benzylthiocarbamoylamino)-C-ethyl-carbonimidoyl]phenoxy]acetate Formula: C19H20N3O3S- MolecularWeight: 370.4454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O3S/c1-2-17(15-8-10-16(11-9-15)25-13-18(23)24)21-22-19(26)20-12-14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3,(H,23,24)(H2,20,22,26)/p-1/b21-17-