[2-(4-fluorophenyl)-4-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-5-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [2-(4-fluorophenyl)-4-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-5-yl]-pyrrolidin-1-yl-methanone Openeye Name: [4-(4-benzyl-1-piperidyl)-2-(4-fluorophenyl)pyrimidin-5-yl]-pyrrolidin-1-yl-methanone CAS Name: [2-(4-fluorophenyl)-4-[4-(phenylmethyl)-1-piperidinyl]-5-pyrimidinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-(4-benzylpiperidin-1-yl)-2-(4-fluorophenyl)pyrimidin-5-yl]-pyrrolidin-1-ylmethanone Traditional Name: [4-(4-benzylpiperidino)-2-(4-fluorophenyl)pyrimidin-5-yl]-pyrrolidino-methanone Formula: C27H29FN4O MolecularWeight: 444.543763

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CN=C(N=C2N3CCC(CC3)CC4=CC=CC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

C1CCN(C1)C(=O)C2=CN=C(N=C2N3CCC(CC3)CC4=CC=CC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H29FN4O/c28-23-10-8-22(9-11-23)25-29-19-24(27(33)32-14-4-5-15-32)26(30-25)31-16-12-21(13-17-31)18-20-6-2-1-3-7-20/h1-3,6-11,19,21H,4-5,12-18H2