2-[[5,6-bis(4-fluorophenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclopentyl-ethanamide

Systemtic Name: 2-[[5,6-bis(4-fluorophenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclopentyl-ethanamide Openeye Name: 2-[[5,6-bis(4-fluorophenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclopentyl-acetamide CAS Name: 2-[[5,6-bis(4-fluorophenyl)-1,2,4-triazin-3-yl]thio]-N-cyclopentylacetamide IUPAC Name: 2-[[5,6-bis(4-fluorophenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclopentylacetamide Traditional Name: 2-[[5,6-bis(4-fluorophenyl)-1,2,4-triazin-3-yl]thio]-N-cyclopentyl-acetamide Formula: C22H20F2N4OS MolecularWeight: 426.482206

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)CSC2=NC(=C(N=N2)C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCC(C1)NC(=O)CSC2=NC(=C(N=N2)C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H20F2N4OS/c23-16-9-5-14(6-10-16)20-21(15-7-11-17(24)12-8-15)27-28-22(26-20)30-13-19(29)25-18-3-1-2-4-18/h5-12,18H,1-4,13H2,(H,25,29)