methyl 5-(1,3-benzothiazol-6-ylcarbonylamino)-2,4-bis(fluoranyl)benzoate

Systemtic Name: methyl 5-(1,3-benzothiazol-6-ylcarbonylamino)-2,4-bis(fluoranyl)benzoate Openeye Name: methyl 5-(1,3-benzothiazole-6-carbonylamino)-2,4-difluoro-benzoate CAS Name: 5-[[1,3-benzothiazol-6-yl(oxo)methyl]amino]-2,4-difluorobenzoic acid methyl ester IUPAC Name: methyl 5-(1,3-benzothiazole-6-carbonylamino)-2,4-difluorobenzoate Traditional Name: 5-(1,3-benzothiazole-6-carbonylamino)-2,4-difluoro-benzoic acid methyl ester Formula: C16H10F2N2O3S MolecularWeight: 348.324006

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)C2=CC3=C(C=C2)N=CS3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)C2=CC3=C(C=C2)N=CS3

InChI

InChI=1S/C16H10F2N2O3S/c1-23-16(22)9-5-13(11(18)6-10(9)17)20-15(21)8-2-3-12-14(4-8)24-7-19-12/h2-7H,1H3,(H,20,21)