2-[4-[(E)-[(4-propan-2-ylphenyl)carbamothioylhydrazinylidene]methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(E)-[(4-propan-2-ylphenyl)carbamothioylhydrazinylidene]methyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[(E)-[(4-isopropylphenyl)carbamothioylhydrazono]methyl]phenoxy]acetic acid CAS Name: 2-[4-[(E)-[[(4-propan-2-ylanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]phenoxy]acetic acid IUPAC Name: 2-[4-[(E)-[(4-propan-2-ylphenyl)carbamothioylhydrazinylidene]methyl]phenoxy]acetic acid Traditional Name: 2-[4-[(E)-(p-cumenylthiocarbamoylhydrazono)methyl]phenoxy]acetic acid Formula: C19H21N3O3S MolecularWeight: 371.45334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)NN=CC2=CC=C(C=C2)OCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O3S/c1-13(2)15-5-7-16(8-6-15)21-19(26)22-20-11-14-3-9-17(10-4-14)25-12-18(23)24/h3-11,13H,12H2,1-2H3,(H,23,24)(H2,21,22,26)/b20-11+