ethyl 2-[2-(3-fluorophenyl)carbonylimino-5,7-dimethyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-(3-fluorophenyl)carbonylimino-5,7-dimethyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-(3-fluorobenzoyl)imino-5,7-dimethyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(3-fluorophenyl)-oxomethyl]imino-5,7-dimethyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(3-fluorobenzoyl)imino-5,7-dimethyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(3-fluorobenzoyl)imino-5,7-dimethyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C20H19FN2O3S MolecularWeight: 386.439863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19FN2O3S/c1-4-26-17(24)11-23-16-9-12(2)8-13(3)18(16)27-20(23)22-19(25)14-6-5-7-15(21)10-14/h5-10H,4,11H2,1-3H3