4-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-N-(2,4,6-trimethylphenyl)butanamide

Systemtic Name: 4-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-N-(2,4,6-trimethylphenyl)butanamide Openeye Name: 4-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-N-(2,4,6-trimethylphenyl)butanamide CAS Name: 4-[(3-fluoro-4-methoxyphenyl)methylthio]-N-(2,4,6-trimethylphenyl)butanamide IUPAC Name: 4-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-N-(2,4,6-trimethylphenyl)butanamide Traditional Name: 4-[(3-fluoro-4-methoxy-benzyl)thio]-N-mesityl-butyramide Formula: C21H26FNO2S MolecularWeight: 375.500043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CCCSCC2=CC(=C(C=C2)OC)F)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CCCSCC2=CC(=C(C=C2)OC)F)C

InChI

InChI=1S/C21H26FNO2S/c1-14-10-15(2)21(16(3)11-14)23-20(24)6-5-9-26-13-17-7-8-19(25-4)18(22)12-17/h7-8,10-12H,5-6,9,13H2,1-4H3,(H,23,24)