[3-[6-(2-azanylpyrimidin-5-yl)-2-morpholin-4-yl-pyrimidin-4-yl]oxyphenyl]-(4-methylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [3-[6-(2-azanylpyrimidin-5-yl)-2-morpholin-4-yl-pyrimidin-4-yl]oxyphenyl]-(4-methylsulfonylpiperazin-1-yl)methanone Openeye Name: [3-[6-(2-aminopyrimidin-5-yl)-2-morpholino-pyrimidin-4-yl]oxyphenyl]-(4-methylsulfonylpiperazin-1-yl)methanone CAS Name: [3-[[6-(2-amino-5-pyrimidinyl)-2-(4-morpholinyl)-4-pyrimidinyl]oxy]phenyl]-(4-methylsulfonyl-1-piperazinyl)methanone IUPAC Name: [3-[6-(2-aminopyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxyphenyl]-(4-methylsulfonylpiperazin-1-yl)methanone Traditional Name: [3-[6-(2-aminopyrimidin-5-yl)-2-morpholino-pyrimidin-4-yl]oxyphenyl]-(4-mesylpiperazino)methanone Formula: C24H28N8O5S MolecularWeight: 540.59472

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)OC3=NC(=NC(=C3)C4=CN=C(N=C4)N)N5CCOCC5

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)OC3=NC(=NC(=C3)C4=CN=C(N=C4)N)N5CCOCC5

InChI

InChI=1S/C24H28N8O5S/c1-38(34,35)32-7-5-30(6-8-32)22(33)17-3-2-4-19(13-17)37-21-14-20(18-15-26-23(25)27-16-18)28-24(29-21)31-9-11-36-12-10-31/h2-4,13-16H,5-12H2,1H3,(H2,25,26,27)