2-[[5-(2-ethoxyphenyl)-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[5-(2-ethoxyphenyl)-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[5-(2-ethoxyphenyl)-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]benzonitrile CAS Name: 2-[[5-(2-ethoxyphenyl)-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]benzonitrile IUPAC Name: 2-[[5-(2-ethoxyphenyl)-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]benzonitrile Traditional Name: 2-[(7-keto-5-o-phenetyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-yl)methyl]benzonitrile Formula: C24H23N5O2 MolecularWeight: 413.47172

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=CC=CC=C3OCC)CC4=CC=CC=C4C#N

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=CC=CC=C3OCC)CC4=CC=CC=C4C#N

InChI

InChI=1S/C24H23N5O2/c1-3-9-19-21-22(29(28-19)15-17-11-6-5-10-16(17)14-25)24(30)27-23(26-21)18-12-7-8-13-20(18)31-4-2/h5-8,10-13H,3-4,9,15H2,1-2H3,(H,26,27,30)