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

Systemtic Name: 2-[[5,6-bis(3-fluorophenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclopentyl-butanamide Openeye Name: 2-[[5,6-bis(3-fluorophenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclopentyl-butanamide CAS Name: 2-[[5,6-bis(3-fluorophenyl)-1,2,4-triazin-3-yl]thio]-N-cyclopentylbutanamide IUPAC Name: 2-[[5,6-bis(3-fluorophenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclopentylbutanamide Traditional Name: 2-[[5,6-bis(3-fluorophenyl)-1,2,4-triazin-3-yl]thio]-N-cyclopentyl-butyramide Formula: C24H24F2N4OS MolecularWeight: 454.535366

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1CCCC1)SC2=NC(=C(N=N2)C3=CC(=CC=C3)F)C4=CC(=CC=C4)F

Isomeric SMILES

CCC(C(=O)NC1CCCC1)SC2=NC(=C(N=N2)C3=CC(=CC=C3)F)C4=CC(=CC=C4)F

InChI

InChI=1S/C24H24F2N4OS/c1-2-20(23(31)27-19-11-3-4-12-19)32-24-28-21(15-7-5-9-17(25)13-15)22(29-30-24)16-8-6-10-18(26)14-16/h5-10,13-14,19-20H,2-4,11-12H2,1H3,(H,27,31)