3-azanyl-4-phenyl-5-sulfanyl-benzenecarbothioic S-acid

Systemtic Name: 3-azanyl-4-phenyl-5-sulfanyl-benzenecarbothioic S-acid Openeye Name: 3-amino-4-phenyl-5-sulfanyl-benzenecarbothioic S-acid CAS Name: 3-amino-5-mercapto-4-phenylbenzenecarbothioic S-acid IUPAC Name: 3-amino-4-phenyl-5-sulfanylbenzenecarbothioic S-acid Traditional Name: 3-amino-5-mercapto-4-phenyl-thiobenzoic acid Formula: C13H11NOS2 MolecularWeight: 261.36254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2S)C(=O)S)N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2S)C(=O)S)N

InChI

InChI=1S/C13H11NOS2/c14-10-6-9(13(15)17)7-11(16)12(10)8-4-2-1-3-5-8/h1-7,16H,14H2,(H,15,17)