5-[(3-fluorophenyl)methylsulfanylmethyl]-N-(3-methylbutyl)furan-2-carboxamide

Systemtic Name: 5-[(3-fluorophenyl)methylsulfanylmethyl]-N-(3-methylbutyl)furan-2-carboxamide Openeye Name: 5-[(3-fluorophenyl)methylsulfanylmethyl]-N-isopentyl-furan-2-carboxamide CAS Name: 5-[[(3-fluorophenyl)methylthio]methyl]-N-(3-methylbutyl)-2-furancarboxamide IUPAC Name: 5-[(3-fluorophenyl)methylsulfanylmethyl]-N-(3-methylbutyl)furan-2-carboxamide Traditional Name: 5-[[(3-fluorobenzyl)thio]methyl]-N-isoamyl-2-furamide Formula: C18H22FNO2S MolecularWeight: 335.436183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC=C(O1)CSCC2=CC(=CC=C2)F

Isomeric SMILES

CC(C)CCNC(=O)C1=CC=C(O1)CSCC2=CC(=CC=C2)F

InChI

InChI=1S/C18H22FNO2S/c1-13(2)8-9-20-18(21)17-7-6-16(22-17)12-23-11-14-4-3-5-15(19)10-14/h3-7,10,13H,8-9,11-12H2,1-2H3,(H,20,21)