N-(3-methoxypropyl)-1-methyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(3-methoxypropyl)-1-methyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(3-methoxypropyl)-1-methyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(3-methoxypropyl)-1-methyl-6-(4-phenyl-1-piperazinyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(3-methoxypropyl)-1-methyl-6-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: 3-methoxypropyl-[1-methyl-6-(4-phenylpiperazino)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C20H27N7O MolecularWeight: 381.47468

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)N3CCN(CC3)C4=CC=CC=C4)NCCCOC

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)N3CCN(CC3)C4=CC=CC=C4)NCCCOC

InChI

InChI=1S/C20H27N7O/c1-25-19-17(15-22-25)18(21-9-6-14-28-2)23-20(24-19)27-12-10-26(11-13-27)16-7-4-3-5-8-16/h3-5,7-8,15H,6,9-14H2,1-2H3,(H,21,23,24)