3-[2-(1H-benzimidazol-2-ylmethyl)-3-(4-fluorophenyl)-2-methyl-piperidin-1-yl]-2-ethyl-6-methyl-4H-pyrimidin-4-amine

Systemtic Name: 3-[2-(1H-benzimidazol-2-ylmethyl)-3-(4-fluorophenyl)-2-methyl-piperidin-1-yl]-2-ethyl-6-methyl-4H-pyrimidin-4-amine Openeye Name: 3-[2-(1H-benzimidazol-2-ylmethyl)-3-(4-fluorophenyl)-2-methyl-1-piperidyl]-2-ethyl-6-methyl-4H-pyrimidin-4-amine CAS Name: 3-[2-(1H-benzimidazol-2-ylmethyl)-3-(4-fluorophenyl)-2-methyl-1-piperidinyl]-2-ethyl-6-methyl-4H-pyrimidin-4-amine IUPAC Name: 3-[2-(1H-benzimidazol-2-ylmethyl)-3-(4-fluorophenyl)-2-methylpiperidin-1-yl]-2-ethyl-6-methyl-4H-pyrimidin-4-amine Traditional Name: [3-[2-(1H-benzimidazol-2-ylmethyl)-3-(4-fluorophenyl)-2-methyl-piperidino]-2-ethyl-6-methyl-4H-pyrimidin-4-yl]amine Formula: C27H33FN6 MolecularWeight: 460.589523

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CC(N1N2CCCC(C2(C)CC3=NC4=CC=CC=C4N3)C5=CC=C(C=C5)F)N)C

Isomeric SMILES

CCC1=NC(=CC(N1N2CCCC(C2(C)CC3=NC4=CC=CC=C4N3)C5=CC=C(C=C5)F)N)C

InChI

InChI=1S/C27H33FN6/c1-4-26-30-18(2)16-24(29)34(26)33-15-7-8-21(19-11-13-20(28)14-12-19)27(33,3)17-25-31-22-9-5-6-10-23(22)32-25/h5-6,9-14,16,21,24H,4,7-8,15,17,29H2,1-3H3,(H,31,32)