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

Systemtic Name: 3-(furan-2-ylmethyl)-2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]quinazolin-4-one Openeye Name: 3-(2-furylmethyl)-2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]quinazolin-4-one CAS Name: 3-(2-furanylmethyl)-2-[[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]methyl]-4-quinazolinone IUPAC Name: 3-(furan-2-ylmethyl)-2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]quinazolin-4-one Traditional Name: 3-(2-furfuryl)-2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]methyl]quinazolin-4-one Formula: C24H24N8O2 MolecularWeight: 456.49976

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC4=NC5=CC=CC=C5C(=O)N4CC6=CC=CO6

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC4=NC5=CC=CC=C5C(=O)N4CC6=CC=CO6

InChI

InChI=1S/C24H24N8O2/c1-29-22-19(13-27-29)23(26-16-25-22)31-10-8-30(9-11-31)15-21-28-20-7-3-2-6-18(20)24(33)32(21)14-17-5-4-12-34-17/h2-7,12-13,16H,8-11,14-15H2,1H3