N4-cyclopentyl-5-fluoranyl-N2-[5-methyl-6-(4-methylpiperazin-1-yl)pyridin-3-yl]pyrimidine-2,4-diamine

Systemtic Name: N4-cyclopentyl-5-fluoranyl-N2-[5-methyl-6-(4-methylpiperazin-1-yl)pyridin-3-yl]pyrimidine-2,4-diamine Openeye Name: N4-cyclopentyl-5-fluoro-N2-[5-methyl-6-(4-methylpiperazin-1-yl)-3-pyridyl]pyrimidine-2,4-diamine CAS Name: N4-cyclopentyl-5-fluoro-N2-[5-methyl-6-(4-methyl-1-piperazinyl)-3-pyridinyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-cyclopentyl-5-fluoro-2-N-[5-methyl-6-(4-methylpiperazin-1-yl)pyridin-3-yl]pyrimidine-2,4-diamine Traditional Name: cyclopentyl-[5-fluoro-2-[[5-methyl-6-(4-methylpiperazino)-3-pyridyl]amino]pyrimidin-4-yl]amine Formula: C20H28FN7 MolecularWeight: 385.481623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CN=C1N2CCN(CC2)C)NC3=NC=C(C(=N3)NC4CCCC4)F

Isomeric SMILES

CC1=CC(=CN=C1N2CCN(CC2)C)NC3=NC=C(C(=N3)NC4CCCC4)F

InChI

InChI=1S/C20H28FN7/c1-14-11-16(12-22-19(14)28-9-7-27(2)8-10-28)25-20-23-13-17(21)18(26-20)24-15-5-3-4-6-15/h11-13,15H,3-10H2,1-2H3,(H2,23,24,25,26)