methyl 2-[5,6,7-tris(fluoranyl)-4-phenylsulfanyl-benzimidazol-1-yl]ethanoate

Systemtic Name: methyl 2-[5,6,7-tris(fluoranyl)-4-phenylsulfanyl-benzimidazol-1-yl]ethanoate Openeye Name: methyl 2-(5,6,7-trifluoro-4-phenylsulfanyl-benzimidazol-1-yl)acetate CAS Name: 2-[5,6,7-trifluoro-4-(phenylthio)-1-benzimidazolyl]acetic acid methyl ester IUPAC Name: methyl 2-(5,6,7-trifluoro-4-phenylsulfanylbenzimidazol-1-yl)acetate Traditional Name: 2-[5,6,7-trifluoro-4-(phenylthio)benzimidazol-1-yl]acetic acid methyl ester Formula: C16H11F3N2O2S MolecularWeight: 352.33095

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C=NC2=C1C(=C(C(=C2SC3=CC=CC=C3)F)F)F

Isomeric SMILES

COC(=O)CN1C=NC2=C1C(=C(C(=C2SC3=CC=CC=C3)F)F)F

InChI

InChI=1S/C16H11F3N2O2S/c1-23-10(22)7-21-8-20-14-15(21)12(18)11(17)13(19)16(14)24-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3