3-[2-oxidanylidene-2-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]ethyl]-6-phenyl-pyrimidin-4-one

Systemtic Name: 3-[2-oxidanylidene-2-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]ethyl]-6-phenyl-pyrimidin-4-one Openeye Name: 3-[2-oxo-2-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]ethyl]-6-phenyl-pyrimidin-4-one CAS Name: 3-[2-oxo-2-[4-[6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]ethyl]-6-phenyl-4-pyrimidinone IUPAC Name: 3-[2-oxo-2-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]ethyl]-6-phenylpyrimidin-4-one Traditional Name: 3-[2-keto-2-[4-(6-pyrrolidinopyrimidin-4-yl)piperazino]ethyl]-6-phenyl-pyrimidin-4-one Formula: C24H27N7O2 MolecularWeight: 445.51688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)CN4C=NC(=CC4=O)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)CN4C=NC(=CC4=O)C5=CC=CC=C5

InChI

InChI=1S/C24H27N7O2/c32-23-14-20(19-6-2-1-3-7-19)27-18-31(23)16-24(33)30-12-10-29(11-13-30)22-15-21(25-17-26-22)28-8-4-5-9-28/h1-3,6-7,14-15,17-18H,4-5,8-13,16H2