N-[(4-ethylphenyl)-(3-fluorophenyl)methyl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[(4-ethylphenyl)-(3-fluorophenyl)methyl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[(4-ethylphenyl)-(3-fluorophenyl)methyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[(4-ethylphenyl)-(3-fluorophenyl)methyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[(4-ethylphenyl)-(3-fluorophenyl)methyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[(4-ethylphenyl)-(3-fluorophenyl)methyl]-2-(methylthio)nicotinamide Formula: C22H21FN2OS MolecularWeight: 380.478343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC(=CC=C2)F)NC(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC(=CC=C2)F)NC(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C22H21FN2OS/c1-3-15-9-11-16(12-10-15)20(17-6-4-7-18(23)14-17)25-21(26)19-8-5-13-24-22(19)27-2/h4-14,20H,3H2,1-2H3,(H,25,26)