2-[(4-phenyldiazenylphenyl)carbamothioyl]benzoic acid

Systemtic Name: 2-[(4-phenyldiazenylphenyl)carbamothioyl]benzoic acid Openeye Name: 2-[(4-phenylazophenyl)carbamothioyl]benzoic acid CAS Name: 2-[(4-phenyldiazenylanilino)-sulfanylidenemethyl]benzoic acid IUPAC Name: 2-[(4-phenyldiazenylphenyl)carbamothioyl]benzoic acid Traditional Name: 2-[(4-phenylazophenyl)thiocarbamoyl]benzoic acid Formula: C20H15N3O2S MolecularWeight: 361.417

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=S)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=S)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C20H15N3O2S/c24-20(25)18-9-5-4-8-17(18)19(26)21-14-10-12-16(13-11-14)23-22-15-6-2-1-3-7-15/h1-13H,(H,21,26)(H,24,25)