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

Systemtic Name: methyl 2-[2-cyclohexylcarbonylimino-4,6-bis(fluoranyl)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(cyclohexanecarbonylimino)-4,6-difluoro-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[cyclohexyl(oxo)methyl]imino-4,6-difluoro-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(cyclohexanecarbonylimino)-4,6-difluoro-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(cyclohexanecarbonylimino)-4,6-difluoro-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C17H18F2N2O3S MolecularWeight: 368.398226

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=C(C=C(C=C2SC1=NC(=O)C3CCCCC3)F)F

Isomeric SMILES

COC(=O)CN1C2=C(C=C(C=C2SC1=NC(=O)C3CCCCC3)F)F

InChI

InChI=1S/C17H18F2N2O3S/c1-24-14(22)9-21-15-12(19)7-11(18)8-13(15)25-17(21)20-16(23)10-5-3-2-4-6-10/h7-8,10H,2-6,9H2,1H3