ethyl 2-[4,6-bis(fluoranyl)-2-naphthalen-2-ylcarbonylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[4,6-bis(fluoranyl)-2-naphthalen-2-ylcarbonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[4,6-difluoro-2-(naphthalene-2-carbonylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[4,6-difluoro-2-[2-naphthalenyl(oxo)methyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4,6-difluoro-2-(naphthalene-2-carbonylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[4,6-difluoro-2-(2-naphthoylimino)-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C22H16F2N2O3S MolecularWeight: 426.435846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC4=CC=CC=C4C=C3)F)F

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC4=CC=CC=C4C=C3)F)F

InChI

InChI=1S/C22H16F2N2O3S/c1-2-29-19(27)12-26-20-17(24)10-16(23)11-18(20)30-22(26)25-21(28)15-8-7-13-5-3-4-6-14(13)9-15/h3-11H,2,12H2,1H3