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

Systemtic Name: 4-[2-[(4-ethoxyphenyl)carbamothioyl]hydrazinyl]benzoic acid Openeye Name: 4-[2-[(4-ethoxyphenyl)carbamothioyl]hydrazino]benzoic acid CAS Name: 4-[[(4-ethoxyanilino)-sulfanylidenemethyl]hydrazo]benzoic acid IUPAC Name: 4-[2-[(4-ethoxyphenyl)carbamothioyl]hydrazinyl]benzoic acid Traditional Name: 4-[N'-(p-phenetylthiocarbamoyl)hydrazino]benzoic acid Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NNC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NNC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H17N3O3S/c1-2-22-14-9-7-12(8-10-14)17-16(23)19-18-13-5-3-11(4-6-13)15(20)21/h3-10,18H,2H2,1H3,(H,20,21)(H2,17,19,23)