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

Systemtic Name: 2-[5-(2-ethoxyphenyl)-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-2-yl]ethanenitrile Openeye Name: 2-[5-(2-ethoxyphenyl)-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-2-yl]acetonitrile CAS Name: 2-[5-(2-ethoxyphenyl)-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-2-yl]acetonitrile IUPAC Name: 2-[5-(2-ethoxyphenyl)-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-2-yl]acetonitrile Traditional Name: 2-(7-keto-5-o-phenetyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-2-yl)acetonitrile Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=NN1CC#N)C(=O)N=C(N2)C3=CC=CC=C3OCC

Isomeric SMILES

CCCC1=C2C(=NN1CC#N)C(=O)N=C(N2)C3=CC=CC=C3OCC

InChI

InChI=1S/C18H19N5O2/c1-3-7-13-15-16(22-23(13)11-10-19)18(24)21-17(20-15)12-8-5-6-9-14(12)25-4-2/h5-6,8-9H,3-4,7,11H2,1-2H3,(H,20,21,24)