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

Systemtic Name: ethyl 2-[2-[2-(4-ethoxyphenyl)ethanoylimino]-4-fluoranyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(4-ethoxyphenyl)acetyl]imino-4-fluoro-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[2-(4-ethoxyphenyl)-1-oxoethyl]imino-4-fluoro-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(4-ethoxyphenyl)acetyl]imino-4-fluoro-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[4-fluoro-2-(2-p-phenetylacetyl)imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C21H21FN2O4S MolecularWeight: 416.465843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC(=O)N=C2N(C3=C(C=CC=C3S2)F)CC(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)CC(=O)N=C2N(C3=C(C=CC=C3S2)F)CC(=O)OCC

InChI

InChI=1S/C21H21FN2O4S/c1-3-27-15-10-8-14(9-11-15)12-18(25)23-21-24(13-19(26)28-4-2)20-16(22)6-5-7-17(20)29-21/h5-11H,3-4,12-13H2,1-2H3