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

Systemtic Name: 4-[7-(2-chloranylphenoxy)-3,4-dihydro-1H-isoquinolin-2-yl]-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine Openeye Name: 4-[7-(2-chlorophenoxy)-3,4-dihydro-1H-isoquinolin-2-yl]-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine CAS Name: 4-[7-(2-chlorophenoxy)-3,4-dihydro-1H-isoquinolin-2-yl]-6-(4-methyl-1-piperazinyl)-2-pyrimidinamine IUPAC Name: 4-[7-(2-chlorophenoxy)-3,4-dihydro-1H-isoquinolin-2-yl]-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine Traditional Name: [4-[7-(2-chlorophenoxy)-3,4-dihydro-1H-isoquinolin-2-yl]-6-(4-methylpiperazino)pyrimidin-2-yl]amine Formula: C24H27ClN6O MolecularWeight: 450.96378

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC(=C2)N3CCC4=C(C3)C=C(C=C4)OC5=CC=CC=C5Cl)N

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC(=C2)N3CCC4=C(C3)C=C(C=C4)OC5=CC=CC=C5Cl)N

InChI

InChI=1S/C24H27ClN6O/c1-29-10-12-30(13-11-29)22-15-23(28-24(26)27-22)31-9-8-17-6-7-19(14-18(17)16-31)32-21-5-3-2-4-20(21)25/h2-7,14-15H,8-13,16H2,1H3,(H2,26,27,28)