1-(5-fluoranylindol-1-yl)-5-(propan-2-ylamino)-4-pyrimidin-4-yl-piperazine-2-carbaldehyde

Systemtic Name: 1-(5-fluoranylindol-1-yl)-5-(propan-2-ylamino)-4-pyrimidin-4-yl-piperazine-2-carbaldehyde Openeye Name: 1-(5-fluoroindol-1-yl)-5-(isopropylamino)-4-pyrimidin-4-yl-piperazine-2-carbaldehyde CAS Name: 1-(5-fluoro-1-indolyl)-5-(propan-2-ylamino)-4-(4-pyrimidinyl)-2-piperazinecarboxaldehyde IUPAC Name: 1-(5-fluoroindol-1-yl)-5-(propan-2-ylamino)-4-pyrimidin-4-ylpiperazine-2-carbaldehyde Traditional Name: 1-(5-fluoroindol-1-yl)-5-(isopropylamino)-4-(4-pyrimidyl)piperazine-2-carbaldehyde Formula: C20H23FN6O MolecularWeight: 382.434623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1CN(C(CN1C2=NC=NC=C2)C=O)N3C=CC4=C3C=CC(=C4)F

Isomeric SMILES

CC(C)NC1CN(C(CN1C2=NC=NC=C2)C=O)N3C=CC4=C3C=CC(=C4)F

InChI

InChI=1S/C20H23FN6O/c1-14(2)24-20-11-27(26-8-6-15-9-16(21)3-4-18(15)26)17(12-28)10-25(20)19-5-7-22-13-23-19/h3-9,12-14,17,20,24H,10-11H2,1-2H3