[4-(phenylmethyl)piperidin-1-yl]-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]methanone

Systemtic Name: [4-(phenylmethyl)piperidin-1-yl]-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-[(3S)-1-pyrimidin-2-yl-3-piperidyl]methanone CAS Name: [4-(phenylmethyl)-1-piperidinyl]-[(3S)-1-(2-pyrimidinyl)-3-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]methanone Traditional Name: (4-benzylpiperidino)-[(3S)-1-(2-pyrimidyl)-3-piperidyl]methanone Formula: C22H28N4O MolecularWeight: 364.48392

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CC=N2)C(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC=CC=N2)C(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H28N4O/c27-21(20-8-4-13-26(17-20)22-23-11-5-12-24-22)25-14-9-19(10-15-25)16-18-6-2-1-3-7-18/h1-3,5-7,11-12,19-20H,4,8-10,13-17H2/t20-/m0/s1