N-[[1-(2-chlorophenyl)pyrazol-4-yl]methyl]-1-pyrimidin-2-yl-piperidin-3-amine

Systemtic Name: N-[[1-(2-chlorophenyl)pyrazol-4-yl]methyl]-1-pyrimidin-2-yl-piperidin-3-amine Openeye Name: N-[[1-(2-chlorophenyl)pyrazol-4-yl]methyl]-1-pyrimidin-2-yl-piperidin-3-amine CAS Name: N-[[1-(2-chlorophenyl)-4-pyrazolyl]methyl]-1-(2-pyrimidinyl)-3-piperidinamine IUPAC Name: N-[[1-(2-chlorophenyl)pyrazol-4-yl]methyl]-1-pyrimidin-2-ylpiperidin-3-amine Traditional Name: [1-(2-chlorophenyl)pyrazol-4-yl]methyl-[1-(2-pyrimidyl)-3-piperidyl]amine Formula: C19H21ClN6 MolecularWeight: 368.86324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CC=N2)NCC3=CN(N=C3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CC(CN(C1)C2=NC=CC=N2)NCC3=CN(N=C3)C4=CC=CC=C4Cl

InChI

InChI=1S/C19H21ClN6/c20-17-6-1-2-7-18(17)26-13-15(12-24-26)11-23-16-5-3-10-25(14-16)19-21-8-4-9-22-19/h1-2,4,6-9,12-13,16,23H,3,5,10-11,14H2