2-(3H-1,3-benzothiazol-2-ylidene)-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-cyano-ethanethioamide

Systemtic Name: 2-(3H-1,3-benzothiazol-2-ylidene)-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-cyano-ethanethioamide Openeye Name: 2-(3H-1,3-benzothiazol-2-ylidene)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-thioacetamide CAS Name: 2-(3H-1,3-benzothiazol-2-ylidene)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoethanethioamide IUPAC Name: 2-(3H-1,3-benzothiazol-2-ylidene)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoethanethioamide Traditional Name: 2-(3H-1,3-benzothiazol-2-ylidene)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-thioacetamide Formula: C17H9ClF3N3S2 MolecularWeight: 411.85167

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C(=S)NC3=C(C=CC(=C3)C(F)(F)F)Cl)S2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C(C#N)C(=S)NC3=C(C=CC(=C3)C(F)(F)F)Cl)S2

InChI

InChI=1S/C17H9ClF3N3S2/c18-11-6-5-9(17(19,20)21)7-13(11)23-15(25)10(8-22)16-24-12-3-1-2-4-14(12)26-16/h1-7,24H,(H,23,25)