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

Systemtic Name: 4-[2-[(4-ethoxycarbonylphenyl)carbamothioyl]hydrazinyl]benzoic acid Openeye Name: 4-[2-[(4-ethoxycarbonylphenyl)carbamothioyl]hydrazino]benzoic acid CAS Name: 4-[[(4-ethoxycarbonylanilino)-sulfanylidenemethyl]hydrazo]benzoic acid IUPAC Name: 4-[2-[(4-ethoxycarbonylphenyl)carbamothioyl]hydrazinyl]benzoic acid Traditional Name: 4-[N'-[(4-carbethoxyphenyl)thiocarbamoyl]hydrazino]benzoic acid Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NNC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NNC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C17H17N3O4S/c1-2-24-16(23)12-5-7-13(8-6-12)18-17(25)20-19-14-9-3-11(4-10-14)15(21)22/h3-10,19H,2H2,1H3,(H,21,22)(H2,18,20,25)