1-(5-fluoranyl-6-methoxy-indol-1-yl)-4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-2-carbaldehyde

Systemtic Name: 1-(5-fluoranyl-6-methoxy-indol-1-yl)-4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-2-carbaldehyde Openeye Name: 1-(5-fluoro-6-methoxy-indol-1-yl)-4-[3-(isopropylamino)-2-pyridyl]piperazine-2-carbaldehyde CAS Name: 1-(5-fluoro-6-methoxy-1-indolyl)-4-[3-(propan-2-ylamino)-2-pyridinyl]-2-piperazinecarboxaldehyde IUPAC Name: 1-(5-fluoro-6-methoxyindol-1-yl)-4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-2-carbaldehyde Traditional Name: 1-(5-fluoro-6-methoxy-indol-1-yl)-4-[3-(isopropylamino)-2-pyridyl]piperazine-2-carbaldehyde Formula: C22H26FN5O2 MolecularWeight: 411.472543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(N=CC=C1)N2CCN(C(C2)C=O)N3C=CC4=CC(=C(C=C43)OC)F

Isomeric SMILES

CC(C)NC1=C(N=CC=C1)N2CCN(C(C2)C=O)N3C=CC4=CC(=C(C=C43)OC)F

InChI

InChI=1S/C22H26FN5O2/c1-15(2)25-19-5-4-7-24-22(19)26-9-10-27(17(13-26)14-29)28-8-6-16-11-18(23)21(30-3)12-20(16)28/h4-8,11-12,14-15,17,25H,9-10,13H2,1-3H3