4-[(E)-[(4-methylphenyl)carbamothioylhydrazinylidene]methyl]benzoic acid

Systemtic Name: 4-[(E)-[(4-methylphenyl)carbamothioylhydrazinylidene]methyl]benzoic acid Openeye Name: 4-[(E)-(p-tolylcarbamothioylhydrazono)methyl]benzoic acid CAS Name: 4-[(E)-[[(4-methylanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-[(4-methylphenyl)carbamothioylhydrazinylidene]methyl]benzoic acid Traditional Name: 4-[(E)-(p-tolylthiocarbamoylhydrazono)methyl]benzoic acid Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NN=CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O2S/c1-11-2-8-14(9-3-11)18-16(22)19-17-10-12-4-6-13(7-5-12)15(20)21/h2-10H,1H3,(H,20,21)(H2,18,19,22)/b17-10+