N-[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]-2,2,3,3,4,4,5,5,5-nonakis(fluoranyl)pentanamide

Systemtic Name: N-[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]-2,2,3,3,4,4,5,5,5-nonakis(fluoranyl)pentanamide Openeye Name: 2,2,3,3,4,4,5,5,5-nonafluoro-N-[4-(4-sec-butylphenyl)thiazol-2-yl]pentanamide CAS Name: N-[4-(4-butan-2-ylphenyl)-2-thiazolyl]-2,2,3,3,4,4,5,5,5-nonafluoropentanamide IUPAC Name: N-[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]-2,2,3,3,4,4,5,5,5-nonafluoropentanamide Traditional Name: 2,2,3,3,4,4,5,5,5-nonafluoro-N-[4-(4-sec-butylphenyl)thiazol-2-yl]valeramide Formula: C18H15F9N2OS MolecularWeight: 478.375129

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C18H15F9N2OS/c1-3-9(2)10-4-6-11(7-5-10)12-8-31-14(28-12)29-13(30)15(19,20)16(21,22)17(23,24)18(25,26)27/h4-9H,3H2,1-2H3,(H,28,29,30)