2-(2-tert-butyl-4-methyl-phenoxy)-1-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-(2-tert-butyl-4-methyl-phenoxy)-1-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]propan-1-one Openeye Name: 2-(2-tert-butyl-4-methyl-phenoxy)-1-[4-(6-morpholinopyrimidin-4-yl)piperazin-1-yl]propan-1-one CAS Name: 2-(2-tert-butyl-4-methylphenoxy)-1-[4-[6-(4-morpholinyl)-4-pyrimidinyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-(2-tert-butyl-4-methylphenoxy)-1-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]propan-1-one Traditional Name: 2-(2-tert-butyl-4-methyl-phenoxy)-1-[4-(6-morpholinopyrimidin-4-yl)piperazino]propan-1-one Formula: C26H37N5O3 MolecularWeight: 467.60368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(C)C(=O)N2CCN(CC2)C3=CC(=NC=N3)N4CCOCC4)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(C)C(=O)N2CCN(CC2)C3=CC(=NC=N3)N4CCOCC4)C(C)(C)C

InChI

InChI=1S/C26H37N5O3/c1-19-6-7-22(21(16-19)26(3,4)5)34-20(2)25(32)31-10-8-29(9-11-31)23-17-24(28-18-27-23)30-12-14-33-15-13-30/h6-7,16-18,20H,8-15H2,1-5H3