N-(2-chloranyl-4,6-dimethyl-phenyl)-2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanyl-propanamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanyl-propanamide Openeye Name: N-(2-chloro-4,6-dimethyl-phenyl)-2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanyl-propanamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-2-[[1-(3-fluorophenyl)-2-imidazolyl]thio]propanamide IUPAC Name: N-(2-chloro-4,6-dimethylphenyl)-2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylpropanamide Traditional Name: N-(2-chloro-4,6-dimethyl-phenyl)-2-[[1-(3-fluorophenyl)imidazol-2-yl]thio]propionamide Formula: C20H19ClFN3OS MolecularWeight: 403.900763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)C(C)SC2=NC=CN2C3=CC(=CC=C3)F)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)C(C)SC2=NC=CN2C3=CC(=CC=C3)F)C

InChI

InChI=1S/C20H19ClFN3OS/c1-12-9-13(2)18(17(21)10-12)24-19(26)14(3)27-20-23-7-8-25(20)16-6-4-5-15(22)11-16/h4-11,14H,1-3H3,(H,24,26)