S-(1,3-benzothiazol-2-yl) 2-(phenylcarbonyl)benzenecarbothioate

Systemtic Name: S-(1,3-benzothiazol-2-yl) 2-(phenylcarbonyl)benzenecarbothioate Openeye Name: S-(1,3-benzothiazol-2-yl) 2-benzoylbenzenecarbothioate CAS Name: 2-benzoylbenzenecarbothioic acid S-(1,3-benzothiazol-2-yl) ester IUPAC Name: S-(1,3-benzothiazol-2-yl) 2-benzoylbenzenecarbothioate Traditional Name: 2-benzoylthiobenzoic acid S-(1,3-benzothiazol-2-yl) ester Formula: C21H13NO2S2 MolecularWeight: 375.46342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)SC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)SC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H13NO2S2/c23-19(14-8-2-1-3-9-14)15-10-4-5-11-16(15)20(24)26-21-22-17-12-6-7-13-18(17)25-21/h1-13H