1-(5-phenyl-3,4-dihydropyrazol-2-yl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione

Systemtic Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione Openeye Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione CAS Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-4-[4-(2-pyrimidinyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)butane-1,4-dione Traditional Name: 1-(3-phenyl-2-pyrazolin-1-yl)-4-[4-(2-pyrimidyl)piperazino]butane-1,4-dione Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC=CC=C2)C(=O)CCC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CN(N=C1C2=CC=CC=C2)C(=O)CCC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H24N6O2/c28-19(25-13-15-26(16-14-25)21-22-10-4-11-23-21)7-8-20(29)27-12-9-18(24-27)17-5-2-1-3-6-17/h1-6,10-11H,7-9,12-16H2