N-[4,6-bis(fluoranyl)-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[4,6-bis(fluoranyl)-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene]-1,3-benzothiazole-6-carboxamide Openeye Name: N-(4,6-difluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,3-benzothiazole-6-carboxamide CAS Name: N-(4,6-difluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(4,6-difluoro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(4,6-difluoro-3-propargyl-1,3-benzothiazol-2-ylidene)-1,3-benzothiazole-6-carboxamide Formula: C18H9F2N3OS2 MolecularWeight: 385.410366

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC4=C(C=C3)N=CS4)F)F

Isomeric SMILES

C#CCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC4=C(C=C3)N=CS4)F)F

InChI

InChI=1S/C18H9F2N3OS2/c1-2-5-23-16-12(20)7-11(19)8-15(16)26-18(23)22-17(24)10-3-4-13-14(6-10)25-9-21-13/h1,3-4,6-9H,5H2