ethyl 3-[2-(4-ethanoylphenyl)carbonylimino-6-fluoranyl-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: ethyl 3-[2-(4-ethanoylphenyl)carbonylimino-6-fluoranyl-1,3-benzothiazol-3-yl]propanoate Openeye Name: ethyl 3-[2-(4-acetylbenzoyl)imino-6-fluoro-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[(4-acetylphenyl)-oxomethyl]imino-6-fluoro-1,3-benzothiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-(4-acetylbenzoyl)imino-6-fluoro-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[2-(4-acetylbenzoyl)imino-6-fluoro-1,3-benzothiazol-3-yl]propionic acid ethyl ester Formula: C21H19FN2O4S MolecularWeight: 414.449963

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=C(C=C(C=C2)F)SC1=NC(=O)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCOC(=O)CCN1C2=C(C=C(C=C2)F)SC1=NC(=O)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H19FN2O4S/c1-3-28-19(26)10-11-24-17-9-8-16(22)12-18(17)29-21(24)23-20(27)15-6-4-14(5-7-15)13(2)25/h4-9,12H,3,10-11H2,1-2H3