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

Systemtic Name: methyl 2-[4,6-bis(fluoranyl)-2-(4-phenylphenyl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[4,6-difluoro-2-(4-phenylbenzoyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[4,6-difluoro-2-[oxo-(4-phenylphenyl)methyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4,6-difluoro-2-(4-phenylbenzoyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[4,6-difluoro-2-(4-phenylbenzoyl)imino-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C23H16F2N2O3S MolecularWeight: 438.446546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H16F2N2O3S/c1-30-20(28)13-27-21-18(25)11-17(24)12-19(21)31-23(27)26-22(29)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-12H,13H2,1H3