2-[(Z)-[(6-methyl-2-oxidanyl-3-propan-2-yl-phenyl)carbamothioylhydrazinylidene]methyl]benzoic acid

Systemtic Name: 2-[(Z)-[(6-methyl-2-oxidanyl-3-propan-2-yl-phenyl)carbamothioylhydrazinylidene]methyl]benzoic acid Openeye Name: 2-[(Z)-[(2-hydroxy-3-isopropyl-6-methyl-phenyl)carbamothioylhydrazono]methyl]benzoic acid CAS Name: 2-[(Z)-[[(2-hydroxy-6-methyl-3-propan-2-ylanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 2-[(Z)-[(2-hydroxy-6-methyl-3-propan-2-ylphenyl)carbamothioylhydrazinylidene]methyl]benzoic acid Traditional Name: 2-[(Z)-[(2-hydroxy-3-isopropyl-6-methyl-phenyl)thiocarbamoylhydrazono]methyl]benzoic acid Formula: C19H21N3O3S MolecularWeight: 371.45334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(C)C)O)NC(=S)NN=CC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=C(C(=C(C=C1)C(C)C)O)NC(=S)N/N=C\C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C19H21N3O3S/c1-11(2)14-9-8-12(3)16(17(14)23)21-19(26)22-20-10-13-6-4-5-7-15(13)18(24)25/h4-11,23H,1-3H3,(H,24,25)(H2,21,22,26)/b20-10-