4-[2-(2-morpholin-4-ium-4-ylethylcarbamothioyl)hydrazinyl]benzoate

Systemtic Name: 4-[2-(2-morpholin-4-ium-4-ylethylcarbamothioyl)hydrazinyl]benzoate Openeye Name: 4-[2-(2-morpholin-4-ium-4-ylethylcarbamothioyl)hydrazino]benzoate CAS Name: 4-[[[2-(4-morpholin-4-iumyl)ethylamino]-sulfanylidenemethyl]hydrazo]benzoate IUPAC Name: 4-[2-(2-morpholin-4-ium-4-ylethylcarbamothioyl)hydrazinyl]benzoate Traditional Name: 4-[N'-(2-morpholin-4-ium-4-ylethylthiocarbamoyl)hydrazino]benzoate Formula: C14H20N4O3S MolecularWeight: 324.3986

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)NNC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)NNC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C14H20N4O3S/c19-13(20)11-1-3-12(4-2-11)16-17-14(22)15-5-6-18-7-9-21-10-8-18/h1-4,16H,5-10H2,(H,19,20)(H2,15,17,22)