N-[2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]ethanamide

Systemtic Name: N-[2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]ethanamide Openeye Name: N-[2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]acetamide CAS Name: N-[2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]acetamide IUPAC Name: N-[2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]acetamide Traditional Name: N-[2-[4-[4-(2-pyrimidyl)piperazino]pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]acetamide Formula: C17H21N9O MolecularWeight: 367.40834

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC(=O)NCCN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C17H21N9O/c1-13(27)18-5-6-26-16-14(11-23-26)15(21-12-22-16)24-7-9-25(10-8-24)17-19-3-2-4-20-17/h2-4,11-12H,5-10H2,1H3,(H,18,27)