3-oxidanylidene-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanenitrile

Systemtic Name: 3-oxidanylidene-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanenitrile Openeye Name: 3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanenitrile CAS Name: 3-oxo-3-[4-(2-pyrimidinyl)-1-piperazinyl]propanenitrile IUPAC Name: 3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanenitrile Traditional Name: 3-keto-3-[4-(2-pyrimidyl)piperazino]propionitrile Formula: C11H13N5O MolecularWeight: 231.25382

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CC#N

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CC#N

InChI

InChI=1S/C11H13N5O/c12-3-2-10(17)15-6-8-16(9-7-15)11-13-4-1-5-14-11/h1,4-5H,2,6-9H2