2-[6-[2-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]hexyl]cyclohex-2-en-1-one

Systemtic Name: 2-[6-[2-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]hexyl]cyclohex-2-en-1-one Openeye Name: 2-[6-[2-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]hexyl]cyclohex-2-en-1-one CAS Name: 2-[6-[2-[2,6-bis(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]hexyl]-1-cyclohex-2-enone IUPAC Name: 2-[6-[2-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]hexyl]cyclohex-2-en-1-one Traditional Name: 2-[6-[2-(2,6-dipyrrolidinopyrimidin-4-yl)piperazino]hexyl]cyclohex-2-en-1-one Formula: C28H44N6O MolecularWeight: 480.68856

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC(=C2)C3CNCCN3CCCCCCC4=CCCCC4=O)N5CCCC5

Isomeric SMILES

C1CCN(C1)C2=NC(=NC(=C2)C3CNCCN3CCCCCCC4=CCCCC4=O)N5CCCC5

InChI

InChI=1S/C28H44N6O/c35-26-13-5-4-12-23(26)11-3-1-2-6-15-32-20-14-29-22-25(32)24-21-27(33-16-7-8-17-33)31-28(30-24)34-18-9-10-19-34/h12,21,25,29H,1-11,13-20,22H2