2-[4-[(Z)-C-methyl-N-[(2-methylphenyl)carbamothioylamino]carbonimidoyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(Z)-C-methyl-N-[(2-methylphenyl)carbamothioylamino]carbonimidoyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[(Z)-C-methyl-N-(o-tolylcarbamothioylamino)carbonimidoyl]phenoxy]acetic acid CAS Name: 2-[4-[(1Z)-1-[[(2-methylanilino)-sulfanylidenemethyl]hydrazinylidene]ethyl]phenoxy]acetic acid IUPAC Name: 2-[4-[(Z)-C-methyl-N-[(2-methylphenyl)carbamothioylamino]carbonimidoyl]phenoxy]acetic acid Traditional Name: 2-[4-[(Z)-C-methyl-N-(o-tolylthiocarbamoylamino)carbonimidoyl]phenoxy]acetic acid Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NN=C(C)C2=CC=C(C=C2)OCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N/N=C(/C)\C2=CC=C(C=C2)OCC(=O)O

InChI

InChI=1S/C18H19N3O3S/c1-12-5-3-4-6-16(12)19-18(25)21-20-13(2)14-7-9-15(10-8-14)24-11-17(22)23/h3-10H,11H2,1-2H3,(H,22,23)(H2,19,21,25)/b20-13-