2-[2-(3-chloranyl-5-fluoranyl-4-oxidanyl-phenyl)-7-fluoranyl-5-oxidanyl-1-benzothiophen-3-yl]furan-3-carbonitrile

Systemtic Name: 2-[2-(3-chloranyl-5-fluoranyl-4-oxidanyl-phenyl)-7-fluoranyl-5-oxidanyl-1-benzothiophen-3-yl]furan-3-carbonitrile Openeye Name: 2-[2-(3-chloro-5-fluoro-4-hydroxy-phenyl)-7-fluoro-5-hydroxy-benzothiophen-3-yl]furan-3-carbonitrile CAS Name: 2-[2-(3-chloro-5-fluoro-4-hydroxyphenyl)-7-fluoro-5-hydroxy-1-benzothiophen-3-yl]-3-furancarbonitrile IUPAC Name: 2-[2-(3-chloro-5-fluoro-4-hydroxyphenyl)-7-fluoro-5-hydroxy-1-benzothiophen-3-yl]furan-3-carbonitrile Traditional Name: 2-[2-(3-chloro-5-fluoro-4-hydroxy-phenyl)-7-fluoro-5-hydroxy-benzothiophen-3-yl]-3-furonitrile Formula: C19H8ClF2NO3S MolecularWeight: 403.786526

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1C#N)C2=C(SC3=C(C=C(C=C23)O)F)C4=CC(=C(C(=C4)Cl)O)F

Isomeric SMILES

C1=COC(=C1C#N)C2=C(SC3=C(C=C(C=C23)O)F)C4=CC(=C(C(=C4)Cl)O)F

InChI

InChI=1S/C19H8ClF2NO3S/c20-12-3-9(4-13(21)16(12)25)18-15(17-8(7-23)1-2-26-17)11-5-10(24)6-14(22)19(11)27-18/h1-6,24-25H