S-phenyl 2-(4-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanethioate

Systemtic Name: S-phenyl 2-(4-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanethioate Openeye Name: S-phenyl 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)ethanethioate CAS Name: 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)ethanethioic acid S-phenyl ester IUPAC Name: S-phenyl 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)ethanethioate Traditional Name: 2-(4-chloro-2-keto-1,3-benzothiazol-3-yl)ethanethioic acid S-phenyl ester Formula: C15H10ClNO2S2 MolecularWeight: 335.8284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC(=O)CN2C3=C(C=CC=C3Cl)SC2=O

Isomeric SMILES

C1=CC=C(C=C1)SC(=O)CN2C3=C(C=CC=C3Cl)SC2=O

InChI

InChI=1S/C15H10ClNO2S2/c16-11-7-4-8-12-14(11)17(15(19)21-12)9-13(18)20-10-5-2-1-3-6-10/h1-8H,9H2