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

Systemtic Name: N-[4-(2-diethylaminoethylsulfonyl)phenyl]-5-fluoranyl-4-[2-methyl-3-(oxan-4-yl)imidazol-4-yl]pyrimidin-2-amine Openeye Name: N-[4-(2-diethylaminoethylsulfonyl)phenyl]-5-fluoro-4-(2-methyl-3-tetrahydropyran-4-yl-imidazol-4-yl)pyrimidin-2-amine CAS Name: N-[4-(2-diethylaminoethylsulfonyl)phenyl]-5-fluoro-4-[2-methyl-3-(4-oxanyl)-4-imidazolyl]-2-pyrimidinamine IUPAC Name: N-[4-(2-diethylaminoethylsulfonyl)phenyl]-5-fluoro-4-[2-methyl-3-(oxan-4-yl)imidazol-4-yl]pyrimidin-2-amine Traditional Name: diethyl-[2-[4-[[5-fluoro-4-(2-methyl-3-tetrahydropyran-4-yl-imidazol-4-yl)pyrimidin-2-yl]amino]phenyl]sulfonylethyl]amine Formula: C25H33FN6O3S MolecularWeight: 516.631323

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCS(=O)(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)C3=CN=C(N3C4CCOCC4)C)F

Isomeric SMILES

CCN(CC)CCS(=O)(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)C3=CN=C(N3C4CCOCC4)C)F

InChI

InChI=1S/C25H33FN6O3S/c1-4-31(5-2)12-15-36(33,34)21-8-6-19(7-9-21)29-25-28-16-22(26)24(30-25)23-17-27-18(3)32(23)20-10-13-35-14-11-20/h6-9,16-17,20H,4-5,10-15H2,1-3H3,(H,28,29,30)