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

Systemtic Name: 2-[4-[(Z)-C-ethyl-N-[(2-methylphenyl)carbamothioylamino]carbonimidoyl]phenoxy]ethanoate Openeye Name: 2-[4-[(Z)-C-ethyl-N-(o-tolylcarbamothioylamino)carbonimidoyl]phenoxy]acetate CAS Name: 2-[4-[(1Z)-1-[[(2-methylanilino)-sulfanylidenemethyl]hydrazinylidene]propyl]phenoxy]acetate IUPAC Name: 2-[4-[(Z)-C-ethyl-N-[(2-methylphenyl)carbamothioylamino]carbonimidoyl]phenoxy]acetate Traditional Name: 2-[4-[(Z)-C-ethyl-N-(o-tolylthiocarbamoylamino)carbonimidoyl]phenoxy]acetate Formula: C19H20N3O3S- MolecularWeight: 370.4454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=S)NC1=CC=CC=C1C)C2=CC=C(C=C2)OCC(=O)[O-]

Isomeric SMILES

CC/C(=N/NC(=S)NC1=CC=CC=C1C)/C2=CC=C(C=C2)OCC(=O)[O-]

InChI

InChI=1S/C19H21N3O3S/c1-3-16(14-8-10-15(11-9-14)25-12-18(23)24)21-22-19(26)20-17-7-5-4-6-13(17)2/h4-11H,3,12H2,1-2H3,(H,23,24)(H2,20,22,26)/p-1/b21-16-