2-[4-[(ethylcarbamothioylhydrazinylidene)methyl]-2-iodanyl-6-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(ethylcarbamothioylhydrazinylidene)methyl]-2-iodanyl-6-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-[(ethylcarbamothioylhydrazono)methyl]-2-iodo-6-methoxy-phenoxy]acetic acid CAS Name: 2-[4-[[[ethylamino(sulfanylidene)methyl]hydrazinylidene]methyl]-2-iodo-6-methoxyphenoxy]acetic acid IUPAC Name: 2-[4-[(ethylcarbamothioylhydrazinylidene)methyl]-2-iodo-6-methoxyphenoxy]acetic acid Traditional Name: 2-[4-[(ethylthiocarbamoylhydrazono)methyl]-2-iodo-6-methoxy-phenoxy]acetic acid Formula: C13H16IN3O4S MolecularWeight: 437.25331

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=CC(=C(C(=C1)I)OCC(=O)O)OC

Isomeric SMILES

CCNC(=S)NN=CC1=CC(=C(C(=C1)I)OCC(=O)O)OC

InChI

InChI=1S/C13H16IN3O4S/c1-3-15-13(22)17-16-6-8-4-9(14)12(10(5-8)20-2)21-7-11(18)19/h4-6H,3,7H2,1-2H3,(H,18,19)(H2,15,17,22)