(2S)-2-[[5-(5-chloranyl-2-methoxy-phenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-fluorophenyl)propanamide

Systemtic Name: (2S)-2-[[5-(5-chloranyl-2-methoxy-phenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-fluorophenyl)propanamide Openeye Name: (2S)-2-[[5-(5-chloro-2-methoxy-phenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-fluorophenyl)propanamide CAS Name: (2S)-2-[[5-(5-chloro-2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(2-fluorophenyl)propanamide IUPAC Name: (2S)-2-[[5-(5-chloro-2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-fluorophenyl)propanamide Traditional Name: (2S)-2-[[5-(5-chloro-2-methoxy-phenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(2-fluorophenyl)propionamide Formula: C18H16ClFN4O2S MolecularWeight: 406.861643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1F)SC2=NNC(=N2)C3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1F)SC2=NNC(=N2)C3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C18H16ClFN4O2S/c1-10(17(25)21-14-6-4-3-5-13(14)20)27-18-22-16(23-24-18)12-9-11(19)7-8-15(12)26-2/h3-10H,1-2H3,(H,21,25)(H,22,23,24)/t10-/m0/s1