1-(5-fluoranylindol-1-yl)-4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-2-carbaldehyde

Systemtic Name: 1-(5-fluoranylindol-1-yl)-4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-2-carbaldehyde Openeye Name: 1-(5-fluoroindol-1-yl)-4-[3-(isopropylamino)-2-pyridyl]piperazine-2-carbaldehyde CAS Name: 1-(5-fluoro-1-indolyl)-4-[3-(propan-2-ylamino)-2-pyridinyl]-2-piperazinecarboxaldehyde IUPAC Name: 1-(5-fluoroindol-1-yl)-4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-2-carbaldehyde Traditional Name: 1-(5-fluoroindol-1-yl)-4-[3-(isopropylamino)-2-pyridyl]piperazine-2-carbaldehyde Formula: C21H24FN5O MolecularWeight: 381.446563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(N=CC=C1)N2CCN(C(C2)C=O)N3C=CC4=C3C=CC(=C4)F

Isomeric SMILES

CC(C)NC1=C(N=CC=C1)N2CCN(C(C2)C=O)N3C=CC4=C3C=CC(=C4)F

InChI

InChI=1S/C21H24FN5O/c1-15(2)24-19-4-3-8-23-21(19)25-10-11-26(18(13-25)14-28)27-9-7-16-12-17(22)5-6-20(16)27/h3-9,12,14-15,18,24H,10-11,13H2,1-2H3