2-[2-methoxy-4-[(E)-N-[(4-methoxyphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2-methoxy-4-[(E)-N-[(4-methoxyphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]phenoxy]ethanoic acid Openeye Name: 2-[2-methoxy-4-[(E)-N-[(4-methoxyphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]phenoxy]acetic acid CAS Name: 2-[2-methoxy-4-[(1E)-1-[[(4-methoxyanilino)-sulfanylidenemethyl]hydrazinylidene]ethyl]phenoxy]acetic acid IUPAC Name: 2-[2-methoxy-4-[(E)-N-[(4-methoxyphenyl)carbamothioylamino]-C-methylcarbonimidoyl]phenoxy]acetic acid Traditional Name: 2-[2-methoxy-4-[(E)-N-[(4-methoxyphenyl)thiocarbamoylamino]-C-methyl-carbonimidoyl]phenoxy]acetic acid Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC1=CC=C(C=C1)OC)C2=CC(=C(C=C2)OCC(=O)O)OC

Isomeric SMILES

C/C(=N\NC(=S)NC1=CC=C(C=C1)OC)/C2=CC(=C(C=C2)OCC(=O)O)OC

InChI

InChI=1S/C19H21N3O5S/c1-12(13-4-9-16(17(10-13)26-3)27-11-18(23)24)21-22-19(28)20-14-5-7-15(25-2)8-6-14/h4-10H,11H2,1-3H3,(H,23,24)(H2,20,22,28)/b21-12+