3-azanyl-4-phenyl-2-sulfanyl-benzenesulfonic acid

Systemtic Name: 3-azanyl-4-phenyl-2-sulfanyl-benzenesulfonic acid Openeye Name: 3-amino-4-phenyl-2-sulfanyl-benzenesulfonic acid CAS Name: 3-amino-2-mercapto-4-phenylbenzenesulfonic acid IUPAC Name: 3-amino-4-phenyl-2-sulfanylbenzenesulfonic acid Traditional Name: 3-amino-2-mercapto-4-phenyl-besylic acid Formula: C12H11NO3S2 MolecularWeight: 281.35064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=C(C=C2)S(=O)(=O)O)S)N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=C(C=C2)S(=O)(=O)O)S)N

InChI

InChI=1S/C12H11NO3S2/c13-11-9(8-4-2-1-3-5-8)6-7-10(12(11)17)18(14,15)16/h1-7,17H,13H2,(H,14,15,16)