2-[3-[4-(2,6-ditert-butylpyrimidin-4-yl)piperazin-1-yl]propoxy]-1H-pyrimidin-6-one

Systemtic Name: 2-[3-[4-(2,6-ditert-butylpyrimidin-4-yl)piperazin-1-yl]propoxy]-1H-pyrimidin-6-one Openeye Name: 2-[3-[4-(2,6-ditert-butylpyrimidin-4-yl)piperazin-1-yl]propoxy]-1H-pyrimidin-6-one CAS Name: 2-[3-[4-(2,6-ditert-butyl-4-pyrimidinyl)-1-piperazinyl]propoxy]-1H-pyrimidin-6-one IUPAC Name: 2-[3-[4-(2,6-ditert-butylpyrimidin-4-yl)piperazin-1-yl]propoxy]-1H-pyrimidin-6-one Traditional Name: 2-[3-[4-(2,6-ditert-butylpyrimidin-4-yl)piperazino]propoxy]-1H-pyrimidin-6-one Formula: C23H36N6O2 MolecularWeight: 428.57094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(=N1)C(C)(C)C)N2CCN(CC2)CCCOC3=NC=CC(=O)N3

Isomeric SMILES

CC(C)(C)C1=CC(=NC(=N1)C(C)(C)C)N2CCN(CC2)CCCOC3=NC=CC(=O)N3

InChI

InChI=1S/C23H36N6O2/c1-22(2,3)17-16-18(26-20(25-17)23(4,5)6)29-13-11-28(12-14-29)10-7-15-31-21-24-9-8-19(30)27-21/h8-9,16H,7,10-15H2,1-6H3,(H,24,27,30)