N-[[4-[2,5-bis(chloranyl)phenyl]-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]cyclopentanecarboxamide

Systemtic Name: N-[[4-[2,5-bis(chloranyl)phenyl]-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]cyclopentanecarboxamide Openeye Name: N-[[4-(2,5-dichlorophenyl)-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]cyclopentanecarboxamide CAS Name: N-[[4-(2,5-dichlorophenyl)-5-[(4-fluorophenyl)methylthio]-1,2,4-triazol-3-yl]methyl]cyclopentanecarboxamide IUPAC Name: N-[[4-(2,5-dichlorophenyl)-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]cyclopentanecarboxamide Traditional Name: N-[[4-(2,5-dichlorophenyl)-5-[(4-fluorobenzyl)thio]-1,2,4-triazol-3-yl]methyl]cyclopentanecarboxamide Formula: C22H21Cl2FN4OS MolecularWeight: 479.397743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)NCC2=NN=C(N2C3=C(C=CC(=C3)Cl)Cl)SCC4=CC=C(C=C4)F

Isomeric SMILES

C1CCC(C1)C(=O)NCC2=NN=C(N2C3=C(C=CC(=C3)Cl)Cl)SCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H21Cl2FN4OS/c23-16-7-10-18(24)19(11-16)29-20(12-26-21(30)15-3-1-2-4-15)27-28-22(29)31-13-14-5-8-17(25)9-6-14/h5-11,15H,1-4,12-13H2,(H,26,30)