4-[2-[(4-phenoxyphenyl)carbamothioyl]hydrazinyl]benzoic acid

Systemtic Name: 4-[2-[(4-phenoxyphenyl)carbamothioyl]hydrazinyl]benzoic acid Openeye Name: 4-[2-[(4-phenoxyphenyl)carbamothioyl]hydrazino]benzoic acid CAS Name: 4-[[(4-phenoxyanilino)-sulfanylidenemethyl]hydrazo]benzoic acid IUPAC Name: 4-[2-[(4-phenoxyphenyl)carbamothioyl]hydrazinyl]benzoic acid Traditional Name: 4-[N'-[(4-phenoxyphenyl)thiocarbamoyl]hydrazino]benzoic acid Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NNC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NNC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H17N3O3S/c24-19(25)14-6-8-16(9-7-14)22-23-20(27)21-15-10-12-18(13-11-15)26-17-4-2-1-3-5-17/h1-13,22H,(H,24,25)(H2,21,23,27)