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

Systemtic Name: N-[(1-methyl-3-phenyl-pyrazol-4-yl)methyl]-1-pyrimidin-2-yl-piperidin-3-amine Openeye Name: N-[(1-methyl-3-phenyl-pyrazol-4-yl)methyl]-1-pyrimidin-2-yl-piperidin-3-amine CAS Name: N-[(1-methyl-3-phenyl-4-pyrazolyl)methyl]-1-(2-pyrimidinyl)-3-piperidinamine IUPAC Name: N-[(1-methyl-3-phenylpyrazol-4-yl)methyl]-1-pyrimidin-2-ylpiperidin-3-amine Traditional Name: (1-methyl-3-phenyl-pyrazol-4-yl)methyl-[1-(2-pyrimidyl)-3-piperidyl]amine Formula: C20H24N6 MolecularWeight: 348.44476

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=CC=C2)CNC3CCCN(C3)C4=NC=CC=N4

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=CC=C2)CNC3CCCN(C3)C4=NC=CC=N4

InChI

InChI=1S/C20H24N6/c1-25-14-17(19(24-25)16-7-3-2-4-8-16)13-23-18-9-5-12-26(15-18)20-21-10-6-11-22-20/h2-4,6-8,10-11,14,18,23H,5,9,12-13,15H2,1H3