1-naphthalen-2-yl-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione

Systemtic Name: 1-naphthalen-2-yl-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione Openeye Name: 1-(2-naphthyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione CAS Name: 1-(2-naphthalenyl)-4-[4-(2-pyrimidinyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-naphthalen-2-yl-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione Traditional Name: 1-(2-naphthyl)-4-[4-(2-pyrimidyl)piperazino]butane-1,4-dione Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CCC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CCC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H22N4O2/c27-20(19-7-6-17-4-1-2-5-18(17)16-19)8-9-21(28)25-12-14-26(15-13-25)22-23-10-3-11-24-22/h1-7,10-11,16H,8-9,12-15H2