ethyl 2-[4-fluoranyl-2-[2-(4-propan-2-ylphenyl)ethanoylimino]-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[4-fluoranyl-2-[2-(4-propan-2-ylphenyl)ethanoylimino]-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[4-fluoro-2-[2-(4-isopropylphenyl)acetyl]imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[4-fluoro-2-[1-oxo-2-(4-propan-2-ylphenyl)ethyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-fluoro-2-[2-(4-propan-2-ylphenyl)acetyl]imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[4-fluoro-2-(2-p-cumenylacetyl)imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C22H23FN2O3S MolecularWeight: 414.493023

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=CC=C2SC1=NC(=O)CC3=CC=C(C=C3)C(C)C)F

Isomeric SMILES

CCOC(=O)CN1C2=C(C=CC=C2SC1=NC(=O)CC3=CC=C(C=C3)C(C)C)F

InChI

InChI=1S/C22H23FN2O3S/c1-4-28-20(27)13-25-21-17(23)6-5-7-18(21)29-22(25)24-19(26)12-15-8-10-16(11-9-15)14(2)3/h5-11,14H,4,12-13H2,1-3H3