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

Systemtic Name: methyl 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]furan-3-carboxylate Openeye Name: methyl 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]furan-3-carboxylate CAS Name: 2-[[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]furan-3-carboxylate Traditional Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]methyl]furan-3-carboxylic acid methyl ester Formula: C17H20N6O3 MolecularWeight: 356.3791

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC4=C(C=CO4)C(=O)OC

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC4=C(C=CO4)C(=O)OC

InChI

InChI=1S/C17H20N6O3/c1-21-15-13(9-20-21)16(19-11-18-15)23-6-4-22(5-7-23)10-14-12(3-8-26-14)17(24)25-2/h3,8-9,11H,4-7,10H2,1-2H3