2-pyridin-4-yl-1-[(3R)-3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]ethanone

Systemtic Name: 2-pyridin-4-yl-1-[(3R)-3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]ethanone Openeye Name: 2-(4-pyridyl)-1-[(3R)-3-(1-pyrimidin-2-yl-4-piperidyl)pyrrolidin-1-yl]ethanone CAS Name: 2-pyridin-4-yl-1-[(3R)-3-[1-(2-pyrimidinyl)-4-piperidinyl]-1-pyrrolidinyl]ethanone IUPAC Name: 2-pyridin-4-yl-1-[(3R)-3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]ethanone Traditional Name: 2-(4-pyridyl)-1-[(3R)-3-[1-(2-pyrimidyl)-4-piperidyl]pyrrolidino]ethanone Formula: C20H25N5O MolecularWeight: 351.4454

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2CCN(C2)C(=O)CC3=CC=NC=C3)C4=NC=CC=N4

Isomeric SMILES

C1CN(C[C@H]1C2CCN(CC2)C3=NC=CC=N3)C(=O)CC4=CC=NC=C4

InChI

InChI=1S/C20H25N5O/c26-19(14-16-2-9-21-10-3-16)25-13-6-18(15-25)17-4-11-24(12-5-17)20-22-7-1-8-23-20/h1-3,7-10,17-18H,4-6,11-15H2/t18-/m0/s1