2-[2-[2-(oxidanylidenemethylidene)-1H-pyrimidin-5-yl]-3-piperazin-1-yl-pyridin-4-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[2-[2-(oxidanylidenemethylidene)-1H-pyrimidin-5-yl]-3-piperazin-1-yl-pyridin-4-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[2-[2-(oxomethylene)-1H-pyrimidin-5-yl]-3-piperazin-1-yl-4-pyridyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[2-[2-(oxomethylidene)-1H-pyrimidin-5-yl]-3-(1-piperazinyl)-4-pyridinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[2-[2-(oxomethylidene)-1H-pyrimidin-5-yl]-3-piperazin-1-ylpyridin-4-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[2-[2-(ketomethylene)-1H-pyrimidin-5-yl]-3-piperazino-4-pyridyl]-1-pyrrolidino-ethanone Formula: C20H24N6O2 MolecularWeight: 380.44356

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CC2=C(C(=NC=C2)C3=CNC(=C=O)N=C3)N4CCNCC4

Isomeric SMILES

C1CCN(C1)C(=O)CC2=C(C(=NC=C2)C3=CNC(=C=O)N=C3)N4CCNCC4

InChI

InChI=1S/C20H24N6O2/c27-14-17-23-12-16(13-24-17)19-20(26-9-5-21-6-10-26)15(3-4-22-19)11-18(28)25-7-1-2-8-25/h3-4,12-13,21,23H,1-2,5-11H2