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

Systemtic Name: 2-[4-bromanyl-2-[(ethylcarbamothioylhydrazinylidene)methyl]phenoxy]ethanoic acid Openeye Name: 2-[4-bromo-2-[(ethylcarbamothioylhydrazono)methyl]phenoxy]acetic acid CAS Name: 2-[4-bromo-2-[[[ethylamino(sulfanylidene)methyl]hydrazinylidene]methyl]phenoxy]acetic acid IUPAC Name: 2-[4-bromo-2-[(ethylcarbamothioylhydrazinylidene)methyl]phenoxy]acetic acid Traditional Name: 2-[4-bromo-2-[(ethylthiocarbamoylhydrazono)methyl]phenoxy]acetic acid Formula: C12H14BrN3O3S MolecularWeight: 360.22686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrN3O3S/c1-2-14-12(20)16-15-6-8-5-9(13)3-4-10(8)19-7-11(17)18/h3-6H,2,7H2,1H3,(H,17,18)(H2,14,16,20)