2-[4-[(7-oxidanylidene-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[(7-oxidanylidene-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(7-oxo-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzonitrile CAS Name: 2-[4-[(7-oxo-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(7-oxo-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(7-keto-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzonitrile Formula: C23H20N4O MolecularWeight: 368.4311

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)N2C(=N1)C=CN2)CC3=CC=C(C=C3)C4=CC=CC=C4C#N

Isomeric SMILES

CCCC1=C(C(=O)N2C(=N1)C=CN2)CC3=CC=C(C=C3)C4=CC=CC=C4C#N

InChI

InChI=1S/C23H20N4O/c1-2-5-21-20(23(28)27-22(26-21)12-13-25-27)14-16-8-10-17(11-9-16)19-7-4-3-6-18(19)15-24/h3-4,6-13,25H,2,5,14H2,1H3