N-[(5-fluoranyl-1-benzothiophen-2-yl)methyl]-2-(oxolan-2-ylmethylsulfanyl)benzamide

Systemtic Name: N-[(5-fluoranyl-1-benzothiophen-2-yl)methyl]-2-(oxolan-2-ylmethylsulfanyl)benzamide Openeye Name: N-[(5-fluorobenzothiophen-2-yl)methyl]-2-(tetrahydrofuran-2-ylmethylsulfanyl)benzamide CAS Name: N-[(5-fluoro-1-benzothiophen-2-yl)methyl]-2-(2-oxolanylmethylthio)benzamide IUPAC Name: N-[(5-fluoro-1-benzothiophen-2-yl)methyl]-2-(oxolan-2-ylmethylsulfanyl)benzamide Traditional Name: N-[(5-fluorobenzothiophen-2-yl)methyl]-2-(tetrahydrofurfurylthio)benzamide Formula: C21H20FNO2S2 MolecularWeight: 401.517403

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CSC2=CC=CC=C2C(=O)NCC3=CC4=C(S3)C=CC(=C4)F

Isomeric SMILES

C1CC(OC1)CSC2=CC=CC=C2C(=O)NCC3=CC4=C(S3)C=CC(=C4)F

InChI

InChI=1S/C21H20FNO2S2/c22-15-7-8-19-14(10-15)11-17(27-19)12-23-21(24)18-5-1-2-6-20(18)26-13-16-4-3-9-25-16/h1-2,5-8,10-11,16H,3-4,9,12-13H2,(H,23,24)