4-(4-methylpiperazin-1-yl)-6-[7-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-isoquinolin-2-yl]pyrimidin-2-amine

Systemtic Name: 4-(4-methylpiperazin-1-yl)-6-[7-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-isoquinolin-2-yl]pyrimidin-2-amine Openeye Name: 4-(4-methylpiperazin-1-yl)-6-[7-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-isoquinolin-2-yl]pyrimidin-2-amine CAS Name: 4-(4-methyl-1-piperazinyl)-6-[7-(1-methyl-4-pyrazolyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-pyrimidinamine IUPAC Name: 4-(4-methylpiperazin-1-yl)-6-[7-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-isoquinolin-2-yl]pyrimidin-2-amine Traditional Name: [4-(4-methylpiperazino)-6-[7-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-isoquinolin-2-yl]pyrimidin-2-yl]amine Formula: C22H28N8 MolecularWeight: 404.51132

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC(=C2)N3CCC4=C(C3)C=C(C=C4)C5=CN(N=C5)C)N

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC(=C2)N3CCC4=C(C3)C=C(C=C4)C5=CN(N=C5)C)N

InChI

InChI=1S/C22H28N8/c1-27-7-9-29(10-8-27)20-12-21(26-22(23)25-20)30-6-5-16-3-4-17(11-18(16)15-30)19-13-24-28(2)14-19/h3-4,11-14H,5-10,15H2,1-2H3,(H2,23,25,26)