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

Systemtic Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]indolizine-1-carbonitrile Openeye Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]indolizine-1-carbonitrile CAS Name: 2-[[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]methyl]-1-indolizinecarbonitrile IUPAC Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]indolizine-1-carbonitrile Traditional Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]methyl]indolizine-1-carbonitrile Formula: C20H20N8 MolecularWeight: 372.4264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC4=CN5C=CC=CC5=C4C#N

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC4=CN5C=CC=CC5=C4C#N

InChI

InChI=1S/C20H20N8/c1-25-19-17(11-24-25)20(23-14-22-19)27-8-6-26(7-9-27)12-15-13-28-5-3-2-4-18(28)16(15)10-21/h2-5,11,13-14H,6-9,12H2,1H3