2-(diethylcarbamothioylamino)benzoic acid

Systemtic Name: 2-(diethylcarbamothioylamino)benzoic acid Openeye Name: 2-(diethylcarbamothioylamino)benzoic acid CAS Name: 2-[[diethylamino(sulfanylidene)methyl]amino]benzoic acid IUPAC Name: 2-(diethylcarbamothioylamino)benzoic acid Traditional Name: 2-(diethylthiocarbamoylamino)benzoic acid Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)NC1=CC=CC=C1C(=O)O

Isomeric SMILES

CCN(CC)C(=S)NC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C12H16N2O2S/c1-3-14(4-2)12(17)13-10-8-6-5-7-9(10)11(15)16/h5-8H,3-4H2,1-2H3,(H,13,17)(H,15,16)