3-[[6-azanyl-4-(furan-2-yl)pyrazolo[3,4-d]pyrimidin-1-yl]methyl]-N-methyl-benzamide

Systemtic Name: 3-[[6-azanyl-4-(furan-2-yl)pyrazolo[3,4-d]pyrimidin-1-yl]methyl]-N-methyl-benzamide Openeye Name: 3-[[6-amino-4-(2-furyl)pyrazolo[3,4-d]pyrimidin-1-yl]methyl]-N-methyl-benzamide CAS Name: 3-[[6-amino-4-(2-furanyl)-1-pyrazolo[3,4-d]pyrimidinyl]methyl]-N-methylbenzamide IUPAC Name: 3-[[6-amino-4-(furan-2-yl)pyrazolo[3,4-d]pyrimidin-1-yl]methyl]-N-methylbenzamide Traditional Name: 3-[[6-amino-4-(2-furyl)pyrazolo[3,4-d]pyrimidin-1-yl]methyl]-N-methyl-benzamide Formula: C18H16N6O2 MolecularWeight: 348.35864

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)CN2C3=NC(=NC(=C3C=N2)C4=CC=CO4)N

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)CN2C3=NC(=NC(=C3C=N2)C4=CC=CO4)N

InChI

InChI=1S/C18H16N6O2/c1-20-17(25)12-5-2-4-11(8-12)10-24-16-13(9-21-24)15(22-18(19)23-16)14-6-3-7-26-14/h2-9H,10H2,1H3,(H,20,25)(H2,19,22,23)