(3R)-3-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-4-(phenylmethyl)piperazin-2-one

Systemtic Name: (3R)-3-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-4-(phenylmethyl)piperazin-2-one Openeye Name: (3R)-4-benzyl-3-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]piperazin-2-one CAS Name: (3R)-3-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-4-(phenylmethyl)-2-piperazinone IUPAC Name: (3R)-4-benzyl-3-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]piperazin-2-one Traditional Name: (3R)-4-benzyl-3-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]piperazin-2-one Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC(=O)N2CCN(CC2)C3=NC=CC=N3)CC4=CC=CC=C4

Isomeric SMILES

C1CN([C@@H](C(=O)N1)CC(=O)N2CCN(CC2)C3=NC=CC=N3)CC4=CC=CC=C4

InChI

InChI=1S/C21H26N6O2/c28-19(25-11-13-26(14-12-25)21-23-7-4-8-24-21)15-18-20(29)22-9-10-27(18)16-17-5-2-1-3-6-17/h1-8,18H,9-16H2,(H,22,29)/t18-/m1/s1