N-[[2-[4-(trifluoromethylsulfanyl)phenyl]-1,3-oxazol-4-yl]methyl]heptan-2-amine

Systemtic Name: N-[[2-[4-(trifluoromethylsulfanyl)phenyl]-1,3-oxazol-4-yl]methyl]heptan-2-amine Openeye Name: N-[[2-[4-(trifluoromethylsulfanyl)phenyl]oxazol-4-yl]methyl]heptan-2-amine CAS Name: N-[[2-[4-(trifluoromethylthio)phenyl]-4-oxazolyl]methyl]-2-heptanamine IUPAC Name: N-[[2-[4-(trifluoromethylsulfanyl)phenyl]-1,3-oxazol-4-yl]methyl]heptan-2-amine Traditional Name: 1-methylhexyl-[[2-[4-(trifluoromethylthio)phenyl]oxazol-4-yl]methyl]amine Formula: C18H23F3N2OS MolecularWeight: 372.44823

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NCC1=COC(=N1)C2=CC=C(C=C2)SC(F)(F)F

Isomeric SMILES

CCCCCC(C)NCC1=COC(=N1)C2=CC=C(C=C2)SC(F)(F)F

InChI

InChI=1S/C18H23F3N2OS/c1-3-4-5-6-13(2)22-11-15-12-24-17(23-15)14-7-9-16(10-8-14)25-18(19,20)21/h7-10,12-13,22H,3-6,11H2,1-2H3