3-[2-[2-(1,3-dihydroisoindol-2-yl)ethyl]piperazin-1-yl]-6-fluoranyl-4-phenyl-1H-indazole

Systemtic Name: 3-[2-[2-(1,3-dihydroisoindol-2-yl)ethyl]piperazin-1-yl]-6-fluoranyl-4-phenyl-1H-indazole Openeye Name: 6-fluoro-3-[2-(2-isoindolin-2-ylethyl)piperazin-1-yl]-4-phenyl-1H-indazole CAS Name: 3-[2-[2-(1,3-dihydroisoindol-2-yl)ethyl]-1-piperazinyl]-6-fluoro-4-phenyl-1H-indazole IUPAC Name: 3-[2-[2-(1,3-dihydroisoindol-2-yl)ethyl]piperazin-1-yl]-6-fluoro-4-phenyl-1H-indazole Traditional Name: 6-fluoro-3-[2-(2-isoindolin-2-ylethyl)piperazino]-4-phenyl-1H-indazole Formula: C27H28FN5 MolecularWeight: 441.543123

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)CCN2CC3=CC=CC=C3C2)C4=NNC5=C4C(=CC(=C5)F)C6=CC=CC=C6

Isomeric SMILES

C1CN(C(CN1)CCN2CC3=CC=CC=C3C2)C4=NNC5=C4C(=CC(=C5)F)C6=CC=CC=C6

InChI

InChI=1S/C27H28FN5/c28-22-14-24(19-6-2-1-3-7-19)26-25(15-22)30-31-27(26)33-13-11-29-16-23(33)10-12-32-17-20-8-4-5-9-21(20)18-32/h1-9,14-15,23,29H,10-13,16-18H2,(H,30,31)