2-(1,3-benzothiazol-2-yl)-2-phenyl-ethanethioic S-acid

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-2-phenyl-ethanethioic S-acid Openeye Name: 2-(1,3-benzothiazol-2-yl)-2-phenyl-ethanethioic S-acid CAS Name: 2-(1,3-benzothiazol-2-yl)-2-phenylethanethioic S-acid IUPAC Name: 2-(1,3-benzothiazol-2-yl)-2-phenylethanethioic S-acid Traditional Name: 2-(1,3-benzothiazol-2-yl)-2-phenyl-thioacetic acid Formula: C15H11NOS2 MolecularWeight: 285.38394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=NC3=CC=CC=C3S2)C(=O)S

Isomeric SMILES

C1=CC=C(C=C1)C(C2=NC3=CC=CC=C3S2)C(=O)S

InChI

InChI=1S/C15H11NOS2/c17-15(18)13(10-6-2-1-3-7-10)14-16-11-8-4-5-9-12(11)19-14/h1-9,13H,(H,17,18)