N-[4-[[3-fluoranyl-5-(oxan-4-ylmethoxymethyl)phenyl]sulfanylmethyl]phenyl]-N-methyl-ethanethioamide

Systemtic Name: N-[4-[[3-fluoranyl-5-(oxan-4-ylmethoxymethyl)phenyl]sulfanylmethyl]phenyl]-N-methyl-ethanethioamide Openeye Name: N-[4-[[3-fluoro-5-(tetrahydropyran-4-ylmethoxymethyl)phenyl]sulfanylmethyl]phenyl]-N-methyl-thioacetamide CAS Name: N-[4-[[[3-fluoro-5-(4-oxanylmethoxymethyl)phenyl]thio]methyl]phenyl]-N-methylethanethioamide IUPAC Name: N-[4-[[3-fluoro-5-(oxan-4-ylmethoxymethyl)phenyl]sulfanylmethyl]phenyl]-N-methylethanethioamide Traditional Name: N-[4-[[[3-fluoro-5-(tetrahydropyran-4-ylmethoxymethyl)phenyl]thio]methyl]phenyl]-N-methyl-thioacetamide Formula: C23H28FNO2S2 MolecularWeight: 433.602323

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)N(C)C1=CC=C(C=C1)CSC2=CC(=CC(=C2)F)COCC3CCOCC3

Isomeric SMILES

CC(=S)N(C)C1=CC=C(C=C1)CSC2=CC(=CC(=C2)F)COCC3CCOCC3

InChI

InChI=1S/C23H28FNO2S2/c1-17(28)25(2)22-5-3-19(4-6-22)16-29-23-12-20(11-21(24)13-23)15-27-14-18-7-9-26-10-8-18/h3-6,11-13,18H,7-10,14-16H2,1-2H3