4-[4-pyridin-4-yl-3-[4-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl]cycloheptan-1-amine

Systemtic Name: 4-[4-pyridin-4-yl-3-[4-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl]cycloheptan-1-amine Openeye Name: 4-[4-(4-pyridyl)-3-[4-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl]cycloheptanamine CAS Name: 4-[4-pyridin-4-yl-3-[4-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl]-1-cycloheptanamine IUPAC Name: 4-[4-pyridin-4-yl-3-[4-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl]cycloheptan-1-amine Traditional Name: [4-[4-(4-pyridyl)-3-[4-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl]cycloheptyl]amine Formula: C22H23F3N4 MolecularWeight: 400.44003

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC(C1)N)C2=C(C(=NN2)C3=CC=C(C=C3)C(F)(F)F)C4=CC=NC=C4

Isomeric SMILES

C1CC(CCC(C1)N)C2=C(C(=NN2)C3=CC=C(C=C3)C(F)(F)F)C4=CC=NC=C4

InChI

InChI=1S/C22H23F3N4/c23-22(24,25)17-7-4-16(5-8-17)21-19(14-10-12-27-13-11-14)20(28-29-21)15-2-1-3-18(26)9-6-15/h4-5,7-8,10-13,15,18H,1-3,6,9,26H2,(H,28,29)