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

Systemtic Name: 4-[7-[1-(cyclobutylmethyl)pyrazol-4-yl]-3-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine Openeye Name: 4-[7-[1-(cyclobutylmethyl)pyrazol-4-yl]-3-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine CAS Name: 4-[7-[1-(cyclobutylmethyl)-4-pyrazolyl]-3-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-6-(4-methyl-1-piperazinyl)-2-pyrimidinamine IUPAC Name: 4-[7-[1-(cyclobutylmethyl)pyrazol-4-yl]-3-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine Traditional Name: [4-[7-[1-(cyclobutylmethyl)pyrazol-4-yl]-3-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-6-(4-methylpiperazino)pyrimidin-2-yl]amine Formula: C27H36N8 MolecularWeight: 472.62834

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(CN1C3=CC(=NC(=N3)N)N4CCN(CC4)C)C=C(C=C2)C5=CN(N=C5)CC6CCC6

Isomeric SMILES

CC1CC2=C(CN1C3=CC(=NC(=N3)N)N4CCN(CC4)C)C=C(C=C2)C5=CN(N=C5)CC6CCC6

InChI

InChI=1S/C27H36N8/c1-19-12-21-6-7-22(24-15-29-34(17-24)16-20-4-3-5-20)13-23(21)18-35(19)26-14-25(30-27(28)31-26)33-10-8-32(2)9-11-33/h6-7,13-15,17,19-20H,3-5,8-12,16,18H2,1-2H3,(H2,28,30,31)