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

Systemtic Name: 2-[[5,6-bis(3-fluorophenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclohexyl-ethanamide Openeye Name: 2-[[5,6-bis(3-fluorophenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclohexyl-acetamide CAS Name: 2-[[5,6-bis(3-fluorophenyl)-1,2,4-triazin-3-yl]thio]-N-cyclohexylacetamide IUPAC Name: 2-[[5,6-bis(3-fluorophenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclohexylacetamide Traditional Name: 2-[[5,6-bis(3-fluorophenyl)-1,2,4-triazin-3-yl]thio]-N-cyclohexyl-acetamide Formula: C23H22F2N4OS MolecularWeight: 440.508786

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CSC2=NC(=C(N=N2)C3=CC(=CC=C3)F)C4=CC(=CC=C4)F

Isomeric SMILES

C1CCC(CC1)NC(=O)CSC2=NC(=C(N=N2)C3=CC(=CC=C3)F)C4=CC(=CC=C4)F

InChI

InChI=1S/C23H22F2N4OS/c24-17-8-4-6-15(12-17)21-22(16-7-5-9-18(25)13-16)28-29-23(27-21)31-14-20(30)26-19-10-2-1-3-11-19/h4-9,12-13,19H,1-3,10-11,14H2,(H,26,30)