N-[3-ethyl-4,6-bis(fluoranyl)-1,3-benzothiazol-2-ylidene]-3,5-dinitro-benzamide

Systemtic Name: N-[3-ethyl-4,6-bis(fluoranyl)-1,3-benzothiazol-2-ylidene]-3,5-dinitro-benzamide Openeye Name: N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)-3,5-dinitro-benzamide CAS Name: N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)-3,5-dinitrobenzamide IUPAC Name: N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)-3,5-dinitrobenzamide Traditional Name: N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)-3,5-dinitro-benzamide Formula: C16H10F2N4O5S MolecularWeight: 408.336206

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])F)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])F)F

InChI

InChI=1S/C16H10F2N4O5S/c1-2-20-14-12(18)5-9(17)6-13(14)28-16(20)19-15(23)8-3-10(21(24)25)7-11(4-8)22(26)27/h3-7H,2H2,1H3