methyl 2-[4,6-bis(fluoranyl)-2-(3-phenoxyphenyl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[4,6-bis(fluoranyl)-2-(3-phenoxyphenyl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[4,6-difluoro-2-(3-phenoxybenzoyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[4,6-difluoro-2-[oxo-(3-phenoxyphenyl)methyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4,6-difluoro-2-(3-phenoxybenzoyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[4,6-difluoro-2-(3-phenoxybenzoyl)imino-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C23H16F2N2O4S MolecularWeight: 454.445946

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC(=CC=C3)OC4=CC=CC=C4)F)F

Isomeric SMILES

COC(=O)CN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC(=CC=C3)OC4=CC=CC=C4)F)F

InChI

InChI=1S/C23H16F2N2O4S/c1-30-20(28)13-27-21-18(25)11-15(24)12-19(21)32-23(27)26-22(29)14-6-5-9-17(10-14)31-16-7-3-2-4-8-16/h2-12H,13H2,1H3