4-(phenylcarbamothioylamino)benzenesulfonic acid

Systemtic Name: 4-(phenylcarbamothioylamino)benzenesulfonic acid Openeye Name: 4-(phenylcarbamothioylamino)benzenesulfonic acid CAS Name: 4-[[anilino(sulfanylidene)methyl]amino]benzenesulfonic acid IUPAC Name: 4-(phenylcarbamothioylamino)benzenesulfonic acid Traditional Name: 4-(phenylthiocarbamoylamino)besylic acid Formula: C13H12N2O3S2 MolecularWeight: 308.37598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)O

InChI

InChI=1S/C13H12N2O3S2/c16-20(17,18)12-8-6-11(7-9-12)15-13(19)14-10-4-2-1-3-5-10/h1-9H,(H2,14,15,19)(H,16,17,18)