N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-fluoranyl-4-methyl-benzamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-fluoranyl-4-methyl-benzamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-fluoro-4-methyl-benzamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-3-fluoro-4-methylbenzamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-fluoro-4-methylbenzamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-3-fluoro-4-methyl-benzamide Formula: C18H17FN2OS MolecularWeight: 328.403783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCSCC2=CC=CC=C2C#N)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCSCC2=CC=CC=C2C#N)F

InChI

InChI=1S/C18H17FN2OS/c1-13-6-7-14(10-17(13)19)18(22)21-8-9-23-12-16-5-3-2-4-15(16)11-20/h2-7,10H,8-9,12H2,1H3,(H,21,22)