2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]quinazolin-4-amine

Systemtic Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]quinazolin-4-amine Openeye Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]quinazolin-4-amine CAS Name: 2-[[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]methyl]-4-quinazolinamine IUPAC Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]quinazolin-4-amine Traditional Name: [2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]methyl]quinazolin-4-yl]amine Formula: C19H21N9 MolecularWeight: 375.43034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC4=NC5=CC=CC=C5C(=N4)N

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC4=NC5=CC=CC=C5C(=N4)N

InChI

InChI=1S/C19H21N9/c1-26-18-14(10-23-26)19(22-12-21-18)28-8-6-27(7-9-28)11-16-24-15-5-3-2-4-13(15)17(20)25-16/h2-5,10,12H,6-9,11H2,1H3,(H2,20,24,25)