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

Systemtic Name: 2-[5-bromanyl-2-ethoxy-4-[(ethylcarbamothioylhydrazinylidene)methyl]phenoxy]ethanoic acid Openeye Name: 2-[5-bromo-2-ethoxy-4-[(ethylcarbamothioylhydrazono)methyl]phenoxy]acetic acid CAS Name: 2-[5-bromo-2-ethoxy-4-[[[ethylamino(sulfanylidene)methyl]hydrazinylidene]methyl]phenoxy]acetic acid IUPAC Name: 2-[5-bromo-2-ethoxy-4-[(ethylcarbamothioylhydrazinylidene)methyl]phenoxy]acetic acid Traditional Name: 2-[5-bromo-2-ethoxy-4-[(ethylthiocarbamoylhydrazono)methyl]phenoxy]acetic acid Formula: C14H18BrN3O4S MolecularWeight: 404.27942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18BrN3O4S/c1-3-16-14(23)18-17-7-9-5-11(21-4-2)12(6-10(9)15)22-8-13(19)20/h5-7H,3-4,8H2,1-2H3,(H,19,20)(H2,16,18,23)