5-fluoranyl-N-[(E)-[5-[[4-(4-methylpiperazin-2-yl)-3-(trifluoromethyl)phenyl]amino]pyridin-2-yl]methylideneamino]-4-morpholin-4-yl-pyrimidin-2-amine

Systemtic Name: 5-fluoranyl-N-[(E)-[5-[[4-(4-methylpiperazin-2-yl)-3-(trifluoromethyl)phenyl]amino]pyridin-2-yl]methylideneamino]-4-morpholin-4-yl-pyrimidin-2-amine Openeye Name: 5-fluoro-N-[(E)-[5-[4-(4-methylpiperazin-2-yl)-3-(trifluoromethyl)anilino]-2-pyridyl]methyleneamino]-4-morpholino-pyrimidin-2-amine CAS Name: 5-fluoro-N-[(E)-[5-[4-(4-methyl-2-piperazinyl)-3-(trifluoromethyl)anilino]-2-pyridinyl]methylideneamino]-4-(4-morpholinyl)-2-pyrimidinamine IUPAC Name: 5-fluoro-N-[(E)-[5-[4-(4-methylpiperazin-2-yl)-3-(trifluoromethyl)anilino]pyridin-2-yl]methylideneamino]-4-morpholin-4-ylpyrimidin-2-amine Traditional Name: (5-fluoro-4-morpholino-pyrimidin-2-yl)-[(E)-[5-[4-(4-methylpiperazin-2-yl)-3-(trifluoromethyl)anilino]-2-pyridyl]methyleneamino]amine Formula: C26H29F4N9O MolecularWeight: 559.561773

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCNC(C1)C2=C(C=C(C=C2)NC3=CN=C(C=C3)C=NNC4=NC=C(C(=N4)N5CCOCC5)F)C(F)(F)F

Isomeric SMILES

CN1CCNC(C1)C2=C(C=C(C=C2)NC3=CN=C(C=C3)/C=N/NC4=NC=C(C(=N4)N5CCOCC5)F)C(F)(F)F

InChI

InChI=1S/C26H29F4N9O/c1-38-7-6-31-23(16-38)20-5-4-17(12-21(20)26(28,29)30)35-19-3-2-18(32-13-19)14-34-37-25-33-15-22(27)24(36-25)39-8-10-40-11-9-39/h2-5,12-15,23,31,35H,6-11,16H2,1H3,(H,33,36,37)/b34-14+