furan-2-yl-[4-(1-methyl-4-phenylazanyl-pyrazolo[3,4-d]pyrimidin-6-yl)piperazin-1-yl]methanone

Systemtic Name: furan-2-yl-[4-(1-methyl-4-phenylazanyl-pyrazolo[3,4-d]pyrimidin-6-yl)piperazin-1-yl]methanone Openeye Name: [4-(4-anilino-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl)piperazin-1-yl]-(2-furyl)methanone CAS Name: [4-(4-anilino-1-methyl-6-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-(2-furanyl)methanone IUPAC Name: [4-(4-anilino-1-methylpyrazolo[3,4-d]pyrimidin-6-yl)piperazin-1-yl]-(furan-2-yl)methanone Traditional Name: [4-(4-anilino-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl)piperazino]-(2-furyl)methanone Formula: C21H21N7O2 MolecularWeight: 403.43714

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)N3CCN(CC3)C(=O)C4=CC=CO4)NC5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)N3CCN(CC3)C(=O)C4=CC=CO4)NC5=CC=CC=C5

InChI

InChI=1S/C21H21N7O2/c1-26-19-16(14-22-26)18(23-15-6-3-2-4-7-15)24-21(25-19)28-11-9-27(10-12-28)20(29)17-8-5-13-30-17/h2-8,13-14H,9-12H2,1H3,(H,23,24,25)