4-[(2R)-1-oxidanylidene-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]oxybenzenecarbonitrile

Systemtic Name: 4-[(2R)-1-oxidanylidene-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]oxybenzenecarbonitrile Openeye Name: 4-[(1R)-1-methyl-2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]benzonitrile CAS Name: 4-[(2R)-1-oxo-1-[4-(2-pyrimidinyl)-1-piperazinyl]propan-2-yl]oxybenzonitrile IUPAC Name: 4-[(2R)-1-oxo-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]oxybenzonitrile Traditional Name: 4-[(1R)-2-keto-1-methyl-2-[4-(2-pyrimidyl)piperazino]ethoxy]benzonitrile Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=NC=CC=N2)OC3=CC=C(C=C3)C#N

Isomeric SMILES

C[C@H](C(=O)N1CCN(CC1)C2=NC=CC=N2)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H19N5O2/c1-14(25-16-5-3-15(13-19)4-6-16)17(24)22-9-11-23(12-10-22)18-20-7-2-8-21-18/h2-8,14H,9-12H2,1H3/t14-/m1/s1