2-(2,3-dimethylphenoxy)-1-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-(2,3-dimethylphenoxy)-1-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]propan-1-one Openeye Name: 2-(2,3-dimethylphenoxy)-1-[4-(6-morpholinopyrimidin-4-yl)piperazin-1-yl]propan-1-one CAS Name: 2-(2,3-dimethylphenoxy)-1-[4-[6-(4-morpholinyl)-4-pyrimidinyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-(2,3-dimethylphenoxy)-1-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]propan-1-one Traditional Name: 2-(2,3-dimethylphenoxy)-1-[4-(6-morpholinopyrimidin-4-yl)piperazino]propan-1-one Formula: C23H31N5O3 MolecularWeight: 425.52394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N5O3/c1-17-5-4-6-20(18(17)2)31-19(3)23(29)28-9-7-26(8-10-28)21-15-22(25-16-24-21)27-11-13-30-14-12-27/h4-6,15-16,19H,7-14H2,1-3H3