N-[2-(4-fluorophenyl)-2-morpholin-4-yl-ethyl]-4-pyrimidin-2-yl-piperazine-1-carboxamide

Systemtic Name: N-[2-(4-fluorophenyl)-2-morpholin-4-yl-ethyl]-4-pyrimidin-2-yl-piperazine-1-carboxamide Openeye Name: N-[2-(4-fluorophenyl)-2-morpholino-ethyl]-4-pyrimidin-2-yl-piperazine-1-carboxamide CAS Name: N-[2-(4-fluorophenyl)-2-(4-morpholinyl)ethyl]-4-(2-pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-4-pyrimidin-2-ylpiperazine-1-carboxamide Traditional Name: N-[2-(4-fluorophenyl)-2-morpholino-ethyl]-4-(2-pyrimidyl)piperazine-1-carboxamide Formula: C21H27FN6O2 MolecularWeight: 414.476483

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)NCC(C3=CC=C(C=C3)F)N4CCOCC4

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)NCC(C3=CC=C(C=C3)F)N4CCOCC4

InChI

InChI=1S/C21H27FN6O2/c22-18-4-2-17(3-5-18)19(26-12-14-30-15-13-26)16-25-21(29)28-10-8-27(9-11-28)20-23-6-1-7-24-20/h1-7,19H,8-16H2,(H,25,29)