N4-cyclopentyl-5-fluoranyl-N2-[3-(4-methylpiperazin-1-yl)phenyl]pyrimidine-2,4-diamine

Systemtic Name: N4-cyclopentyl-5-fluoranyl-N2-[3-(4-methylpiperazin-1-yl)phenyl]pyrimidine-2,4-diamine Openeye Name: N4-cyclopentyl-5-fluoro-N2-[3-(4-methylpiperazin-1-yl)phenyl]pyrimidine-2,4-diamine CAS Name: N4-cyclopentyl-5-fluoro-N2-[3-(4-methyl-1-piperazinyl)phenyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-cyclopentyl-5-fluoro-2-N-[3-(4-methylpiperazin-1-yl)phenyl]pyrimidine-2,4-diamine Traditional Name: cyclopentyl-[5-fluoro-2-[3-(4-methylpiperazino)anilino]pyrimidin-4-yl]amine Formula: C20H27FN6 MolecularWeight: 370.466983

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=CC=C2)NC3=NC=C(C(=N3)NC4CCCC4)F

Isomeric SMILES

CN1CCN(CC1)C2=CC(=CC=C2)NC3=NC=C(C(=N3)NC4CCCC4)F

InChI

InChI=1S/C20H27FN6/c1-26-9-11-27(12-10-26)17-8-4-7-16(13-17)24-20-22-14-18(21)19(25-20)23-15-5-2-3-6-15/h4,7-8,13-15H,2-3,5-6,9-12H2,1H3,(H2,22,23,24,25)