5-(4-azanyl-3-fluoranyl-phenyl)-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-(4-azanyl-3-fluoranyl-phenyl)-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 5-(4-amino-3-fluoro-phenyl)-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 5-(4-amino-3-fluorophenyl)-7-[4-(4-methyl-1-piperazinyl)cyclohexyl]-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 5-(4-amino-3-fluorophenyl)-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [5-(4-amino-3-fluoro-phenyl)-7-[4-(4-methylpiperazino)cyclohexyl]pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C23H30FN7 MolecularWeight: 423.529603

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCC(CC2)N3C=C(C4=C3N=CN=C4N)C5=CC(=C(C=C5)N)F

Isomeric SMILES

CN1CCN(CC1)C2CCC(CC2)N3C=C(C4=C3N=CN=C4N)C5=CC(=C(C=C5)N)F

InChI

InChI=1S/C23H30FN7/c1-29-8-10-30(11-9-29)16-3-5-17(6-4-16)31-13-18(15-2-7-20(25)19(24)12-15)21-22(26)27-14-28-23(21)31/h2,7,12-14,16-17H,3-6,8-11,25H2,1H3,(H2,26,27,28)