N-[4,6-bis(fluoranyl)-3-propyl-1,3-benzothiazol-2-ylidene]-4-cyano-benzamide

Systemtic Name: N-[4,6-bis(fluoranyl)-3-propyl-1,3-benzothiazol-2-ylidene]-4-cyano-benzamide Openeye Name: 4-cyano-N-(4,6-difluoro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 4-cyano-N-(4,6-difluoro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 4-cyano-N-(4,6-difluoro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 4-cyano-N-(4,6-difluoro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C18H13F2N3OS MolecularWeight: 357.377126

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC=C(C=C3)C#N)F)F

Isomeric SMILES

CCCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC=C(C=C3)C#N)F)F

InChI

InChI=1S/C18H13F2N3OS/c1-2-7-23-16-14(20)8-13(19)9-15(16)25-18(23)22-17(24)12-5-3-11(10-21)4-6-12/h3-6,8-9H,2,7H2,1H3