[4-[(4-arsonophenyl)carbamothioylamino]phenyl]arsonic acid

Systemtic Name: [4-[(4-arsonophenyl)carbamothioylamino]phenyl]arsonic acid Openeye Name: [4-[(4-arsonophenyl)carbamothioylamino]phenyl]arsonic acid CAS Name: [4-[[(4-arsonoanilino)-sulfanylidenemethyl]amino]phenyl]arsonic acid IUPAC Name: [4-[(4-arsonophenyl)carbamothioylamino]phenyl]arsonic acid Traditional Name: [4-[(4-arsonophenyl)thiocarbamoylamino]phenyl]arsonic acid Formula: C13H14As2N2O6S MolecularWeight: 476.16826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC2=CC=C(C=C2)[As](=O)(O)O)[As](=O)(O)O

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC2=CC=C(C=C2)[As](=O)(O)O)[As](=O)(O)O

InChI

InChI=1S/C13H14As2N2O6S/c18-14(19,20)9-1-5-11(6-2-9)16-13(24)17-12-7-3-10(4-8-12)15(21,22)23/h1-8H,(H2,16,17,24)(H2,18,19,20)(H2,21,22,23)