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

Systemtic Name: 3-pyridin-3-yl-1-[(3R)-3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]propan-1-one Openeye Name: 3-(3-pyridyl)-1-[(3R)-3-(1-pyrimidin-2-yl-4-piperidyl)pyrrolidin-1-yl]propan-1-one CAS Name: 3-(3-pyridinyl)-1-[(3R)-3-[1-(2-pyrimidinyl)-4-piperidinyl]-1-pyrrolidinyl]-1-propanone IUPAC Name: 3-pyridin-3-yl-1-[(3R)-3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]propan-1-one Traditional Name: 3-(3-pyridyl)-1-[(3R)-3-[1-(2-pyrimidyl)-4-piperidyl]pyrrolidino]propan-1-one Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2CCN(C2)C(=O)CCC3=CN=CC=C3)C4=NC=CC=N4

Isomeric SMILES

C1CN(C[C@H]1C2CCN(CC2)C3=NC=CC=N3)C(=O)CCC4=CN=CC=C4

InChI

InChI=1S/C21H27N5O/c27-20(5-4-17-3-1-9-22-15-17)26-14-8-19(16-26)18-6-12-25(13-7-18)21-23-10-2-11-24-21/h1-3,9-11,15,18-19H,4-8,12-14,16H2/t19-/m0/s1