N-(6-butyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-3,4,5-trimethoxy-benzamide

Systemtic Name: N-(6-butyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-3,4,5-trimethoxy-benzamide Openeye Name: N-(6-butyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-3,4,5-trimethoxy-benzamide CAS Name: N-(6-butyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-3,4,5-trimethoxybenzamide IUPAC Name: N-(6-butyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-3,4,5-trimethoxybenzamide Traditional Name: N-(6-butyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-3,4,5-trimethoxy-benzamide Formula: C19H23N5O4 MolecularWeight: 385.41702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=NN2)C(=N1)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCCCC1=NC2=C(C=NN2)C(=N1)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C19H23N5O4/c1-5-6-7-15-21-17(12-10-20-24-18(12)22-15)23-19(25)11-8-13(26-2)16(28-4)14(9-11)27-3/h8-10H,5-7H2,1-4H3,(H2,20,21,22,23,24,25)