2-[(4-methylphenyl)sulfonylcarbamothioylamino]ethanoic acid

Systemtic Name: 2-[(4-methylphenyl)sulfonylcarbamothioylamino]ethanoic acid Openeye Name: 2-(p-tolylsulfonylcarbamothioylamino)acetic acid CAS Name: 2-[[[(4-methylphenyl)sulfonylamino]-sulfanylidenemethyl]amino]acetic acid IUPAC Name: 2-[(4-methylphenyl)sulfonylcarbamothioylamino]acetic acid Traditional Name: 2-(tosylthiocarbamoylamino)acetic acid Formula: C10H12N2O4S2 MolecularWeight: 288.34328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=S)NCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=S)NCC(=O)O

InChI

InChI=1S/C10H12N2O4S2/c1-7-2-4-8(5-3-7)18(15,16)12-10(17)11-6-9(13)14/h2-5H,6H2,1H3,(H,13,14)(H2,11,12,17)