2-[5-bromanyl-4-[(ethylcarbamothioylhydrazinylidene)methyl]-2-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[5-bromanyl-4-[(ethylcarbamothioylhydrazinylidene)methyl]-2-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[5-bromo-4-[(ethylcarbamothioylhydrazono)methyl]-2-methoxy-phenoxy]acetic acid CAS Name: 2-[5-bromo-4-[[[ethylamino(sulfanylidene)methyl]hydrazinylidene]methyl]-2-methoxyphenoxy]acetic acid IUPAC Name: 2-[5-bromo-4-[(ethylcarbamothioylhydrazinylidene)methyl]-2-methoxyphenoxy]acetic acid Traditional Name: 2-[5-bromo-4-[(ethylthiocarbamoylhydrazono)methyl]-2-methoxy-phenoxy]acetic acid Formula: C13H16BrN3O4S MolecularWeight: 390.25284

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=CC(=C(C=C1Br)OCC(=O)O)OC

Isomeric SMILES

CCNC(=S)NN=CC1=CC(=C(C=C1Br)OCC(=O)O)OC

InChI

InChI=1S/C13H16BrN3O4S/c1-3-15-13(22)17-16-6-8-4-10(20-2)11(5-9(8)14)21-7-12(18)19/h4-6H,3,7H2,1-2H3,(H,18,19)(H2,15,17,22)