4-(5-fluoranyl-2-pyridin-2-yl-1H-indol-3-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-(5-fluoranyl-2-pyridin-2-yl-1H-indol-3-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Openeye Name: 4-[5-fluoro-2-(2-pyridyl)-1H-indol-3-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one CAS Name: 4-[5-fluoro-2-(2-pyridinyl)-1H-indol-3-yl]-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(5-fluoro-2-pyridin-2-yl-1H-indol-3-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Traditional Name: 4-[5-fluoro-2-(2-pyridyl)-1H-indol-3-yl]-1-[4-(2-pyrimidyl)piperazino]butan-1-one Formula: C25H25FN6O MolecularWeight: 444.504003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CCCC3=C(NC4=C3C=C(C=C4)F)C5=CC=CC=N5

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CCCC3=C(NC4=C3C=C(C=C4)F)C5=CC=CC=N5

InChI

InChI=1S/C25H25FN6O/c26-18-8-9-21-20(17-18)19(24(30-21)22-6-1-2-10-27-22)5-3-7-23(33)31-13-15-32(16-14-31)25-28-11-4-12-29-25/h1-2,4,6,8-12,17,30H,3,5,7,13-16H2