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

Systemtic Name: 4-[7-(4-chloranylpyrazol-1-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine Openeye Name: 4-[7-(4-chloropyrazol-1-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine CAS Name: 4-[7-(4-chloro-1-pyrazolyl)-3,4-dihydro-1H-isoquinolin-2-yl]-6-(4-methyl-1-piperazinyl)-2-pyrimidinamine IUPAC Name: 4-[7-(4-chloropyrazol-1-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine Traditional Name: [4-[7-(4-chloropyrazol-1-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-6-(4-methylpiperazino)pyrimidin-2-yl]amine Formula: C21H25ClN8 MolecularWeight: 424.9298

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC(=C2)N3CCC4=C(C3)C=C(C=C4)N5C=C(C=N5)Cl)N

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC(=C2)N3CCC4=C(C3)C=C(C=C4)N5C=C(C=N5)Cl)N

InChI

InChI=1S/C21H25ClN8/c1-27-6-8-28(9-7-27)19-11-20(26-21(23)25-19)29-5-4-15-2-3-18(10-16(15)13-29)30-14-17(22)12-24-30/h2-3,10-12,14H,4-9,13H2,1H3,(H2,23,25,26)