3-(methylcarbamothioylamino)benzoic acid

Systemtic Name: 3-(methylcarbamothioylamino)benzoic acid Openeye Name: 3-(methylcarbamothioylamino)benzoic acid CAS Name: 3-[[methylamino(sulfanylidene)methyl]amino]benzoic acid IUPAC Name: 3-(methylcarbamothioylamino)benzoic acid Traditional Name: 3-(methylthiocarbamoylamino)benzoic acid Formula: C9H10N2O2S MolecularWeight: 210.2529

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=CC=CC(=C1)C(=O)O

Isomeric SMILES

CNC(=S)NC1=CC=CC(=C1)C(=O)O

InChI

InChI=1S/C9H10N2O2S/c1-10-9(14)11-7-4-2-3-6(5-7)8(12)13/h2-5H,1H3,(H,12,13)(H2,10,11,14)