2-(3-methylphenoxy)-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-(3-methylphenoxy)-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one Openeye Name: 2-(3-methylphenoxy)-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one CAS Name: 2-(3-methylphenoxy)-1-[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: 2-(3-methylphenoxy)-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one Traditional Name: 2-(3-methylphenoxy)-1-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]propan-1-one Formula: C20H24N6O2 MolecularWeight: 380.44356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(C)C(=O)N2CCN(CC2)C3=NC=NC4=C3C=NN4C

Isomeric SMILES

CC1=CC(=CC=C1)OC(C)C(=O)N2CCN(CC2)C3=NC=NC4=C3C=NN4C

InChI

InChI=1S/C20H24N6O2/c1-14-5-4-6-16(11-14)28-15(2)20(27)26-9-7-25(8-10-26)19-17-12-23-24(3)18(17)21-13-22-19/h4-6,11-13,15H,7-10H2,1-3H3