4-[5-fluoranyl-6-piperazin-1-yl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine

Systemtic Name: 4-[5-fluoranyl-6-piperazin-1-yl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine Openeye Name: 4-[5-fluoro-6-piperazin-1-yl-2-[4-(2-pyridyl)piperazin-1-yl]pyrimidin-4-yl]morpholine CAS Name: 4-[5-fluoro-6-(1-piperazinyl)-2-[4-(2-pyridinyl)-1-piperazinyl]-4-pyrimidinyl]morpholine IUPAC Name: 4-[5-fluoro-6-piperazin-1-yl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine Traditional Name: 4-[5-fluoro-6-piperazino-2-[4-(2-pyridyl)piperazino]pyrimidin-4-yl]morpholine Formula: C21H29FN8O MolecularWeight: 428.506363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C(=NC(=N2)N3CCN(CC3)C4=CC=CC=N4)N5CCOCC5)F

Isomeric SMILES

C1CN(CCN1)C2=C(C(=NC(=N2)N3CCN(CC3)C4=CC=CC=N4)N5CCOCC5)F

InChI

InChI=1S/C21H29FN8O/c22-18-19(28-7-5-23-6-8-28)25-21(26-20(18)29-13-15-31-16-14-29)30-11-9-27(10-12-30)17-3-1-2-4-24-17/h1-4,23H,5-16H2