3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-4-(oxolan-2-ylmethyl)-5-propan-2-yl-1,2,4-triazole

Systemtic Name: 3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-4-(oxolan-2-ylmethyl)-5-propan-2-yl-1,2,4-triazole Openeye Name: 3-[(2-chloro-4-fluoro-phenyl)methylsulfanyl]-5-isopropyl-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazole CAS Name: 3-[(2-chloro-4-fluorophenyl)methylthio]-4-(2-oxolanylmethyl)-5-propan-2-yl-1,2,4-triazole IUPAC Name: 3-[(2-chloro-4-fluorophenyl)methylsulfanyl]-4-(oxolan-2-ylmethyl)-5-propan-2-yl-1,2,4-triazole Traditional Name: 3-[(2-chloro-4-fluoro-benzyl)thio]-5-isopropyl-4-(tetrahydrofurfuryl)-1,2,4-triazole Formula: C17H21ClFN3OS MolecularWeight: 369.884543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1CC2CCCO2)SCC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CC(C)C1=NN=C(N1CC2CCCO2)SCC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C17H21ClFN3OS/c1-11(2)16-20-21-17(22(16)9-14-4-3-7-23-14)24-10-12-5-6-13(19)8-15(12)18/h5-6,8,11,14H,3-4,7,9-10H2,1-2H3