5-[1-(3-methylthiophen-2-yl)ethyl]-N-[4-(trifluoromethyl)phenyl]-2,5-diazabicyclo[2.2.1]heptane-2-carboxamide

Systemtic Name: 5-[1-(3-methylthiophen-2-yl)ethyl]-N-[4-(trifluoromethyl)phenyl]-2,5-diazabicyclo[2.2.1]heptane-2-carboxamide Openeye Name: 5-[1-(3-methyl-2-thienyl)ethyl]-N-[4-(trifluoromethyl)phenyl]-2,5-diazabicyclo[2.2.1]heptane-2-carboxamide CAS Name: 5-[1-(3-methyl-2-thiophenyl)ethyl]-N-[4-(trifluoromethyl)phenyl]-2,5-diazabicyclo[2.2.1]heptane-2-carboxamide IUPAC Name: 5-[1-(3-methylthiophen-2-yl)ethyl]-N-[4-(trifluoromethyl)phenyl]-2,5-diazabicyclo[2.2.1]heptane-2-carboxamide Traditional Name: 5-[1-(3-methyl-2-thienyl)ethyl]-N-[4-(trifluoromethyl)phenyl]-2,5-diazabicyclo[2.2.1]heptane-2-carboxamide Formula: C20H22F3N3OS MolecularWeight: 409.46839

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(C)N2CC3CC2CN3C(=O)NC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CC1=C(SC=C1)C(C)N2CC3CC2CN3C(=O)NC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C20H22F3N3OS/c1-12-7-8-28-18(12)13(2)25-10-17-9-16(25)11-26(17)19(27)24-15-5-3-14(4-6-15)20(21,22)23/h3-8,13,16-17H,9-11H2,1-2H3,(H,24,27)