4-[2-[(3-fluoranyl-4-methyl-phenyl)carbamothioyl]hydrazinyl]benzoic acid

Systemtic Name: 4-[2-[(3-fluoranyl-4-methyl-phenyl)carbamothioyl]hydrazinyl]benzoic acid Openeye Name: 4-[2-[(3-fluoro-4-methyl-phenyl)carbamothioyl]hydrazino]benzoic acid CAS Name: 4-[[(3-fluoro-4-methylanilino)-sulfanylidenemethyl]hydrazo]benzoic acid IUPAC Name: 4-[2-[(3-fluoro-4-methylphenyl)carbamothioyl]hydrazinyl]benzoic acid Traditional Name: 4-[N'-[(3-fluoro-4-methyl-phenyl)thiocarbamoyl]hydrazino]benzoic acid Formula: C15H14FN3O2S MolecularWeight: 319.353963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC2=CC=C(C=C2)C(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC2=CC=C(C=C2)C(=O)O)F

InChI

InChI=1S/C15H14FN3O2S/c1-9-2-5-12(8-13(9)16)17-15(22)19-18-11-6-3-10(4-7-11)14(20)21/h2-8,18H,1H3,(H,20,21)(H2,17,19,22)