2-[4-[(Z)-N-[(2,6-dimethylphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]phenoxy]ethanoate

Systemtic Name: 2-[4-[(Z)-N-[(2,6-dimethylphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]phenoxy]ethanoate Openeye Name: 2-[4-[(Z)-N-[(2,6-dimethylphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]phenoxy]acetate CAS Name: 2-[4-[(1Z)-1-[[(2,6-dimethylanilino)-sulfanylidenemethyl]hydrazinylidene]ethyl]phenoxy]acetate IUPAC Name: 2-[4-[(Z)-N-[(2,6-dimethylphenyl)carbamothioylamino]-C-methylcarbonimidoyl]phenoxy]acetate Traditional Name: 2-[4-[(Z)-N-[(2,6-dimethylphenyl)thiocarbamoylamino]-C-methyl-carbonimidoyl]phenoxy]acetate Formula: C19H20N3O3S- MolecularWeight: 370.4454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)NN=C(C)C2=CC=C(C=C2)OCC(=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)N/N=C(/C)\C2=CC=C(C=C2)OCC(=O)[O-]

InChI

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