2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(3-fluoranyl-4-methyl-phenyl)benzamide

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(3-fluoranyl-4-methyl-phenyl)benzamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-(3-fluoro-4-methyl-phenyl)benzamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-(3-fluoro-4-methylphenyl)benzamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(3-fluoro-4-methylphenyl)benzamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-(3-fluoro-4-methyl-phenyl)benzamide Formula: C20H19FN2O2S MolecularWeight: 370.440463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=C(ON=C3C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=C(ON=C3C)C)F

InChI

InChI=1S/C20H19FN2O2S/c1-12-8-9-15(10-18(12)21)22-20(24)16-6-4-5-7-19(16)26-11-17-13(2)23-25-14(17)3/h4-10H,11H2,1-3H3,(H,22,24)