2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-2-phenyl-ethanethioic S-acid

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-2-phenyl-ethanethioic S-acid Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-2-phenyl-ethanethioic S-acid CAS Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-2-phenylethanethioic S-acid IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-2-phenylethanethioic S-acid Traditional Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-2-phenyl-thioacetic acid Formula: C15H10ClNOS3 MolecularWeight: 351.894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)S)SC2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)S)SC2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C15H10ClNOS3/c16-10-6-7-12-11(8-10)17-15(20-12)21-13(14(18)19)9-4-2-1-3-5-9/h1-8,13H,(H,18,19)