5-fluoranyl-N-[3-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-4-[2-methyl-3-(oxan-4-yl)imidazol-4-yl]pyrimidin-2-amine

Systemtic Name: 5-fluoranyl-N-[3-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-4-[2-methyl-3-(oxan-4-yl)imidazol-4-yl]pyrimidin-2-amine Openeye Name: 5-fluoro-N-[3-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-4-(2-methyl-3-tetrahydropyran-4-yl-imidazol-4-yl)pyrimidin-2-amine CAS Name: 5-fluoro-N-[3-methyl-4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-4-[2-methyl-3-(4-oxanyl)-4-imidazolyl]-2-pyrimidinamine IUPAC Name: 5-fluoro-N-[3-methyl-4-(4-methylpiperazin-1-yl)sulfonylphenyl]-4-[2-methyl-3-(oxan-4-yl)imidazol-4-yl]pyrimidin-2-amine Traditional Name: [5-fluoro-4-(2-methyl-3-tetrahydropyran-4-yl-imidazol-4-yl)pyrimidin-2-yl]-[3-methyl-4-(4-methylpiperazino)sulfonyl-phenyl]amine Formula: C25H32FN7O3S MolecularWeight: 529.630083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC=C(C(=N2)C3=CN=C(N3C4CCOCC4)C)F)S(=O)(=O)N5CCN(CC5)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=C(C(=N2)C3=CN=C(N3C4CCOCC4)C)F)S(=O)(=O)N5CCN(CC5)C

InChI

InChI=1S/C25H32FN7O3S/c1-17-14-19(4-5-23(17)37(34,35)32-10-8-31(3)9-11-32)29-25-28-15-21(26)24(30-25)22-16-27-18(2)33(22)20-6-12-36-13-7-20/h4-5,14-16,20H,6-13H2,1-3H3,(H,28,29,30)