2-[4-[[(5-methoxypyrazolo[1,5-a]pyrimidin-7-yl)amino]methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[[(5-methoxypyrazolo[1,5-a]pyrimidin-7-yl)amino]methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[[(5-methoxypyrazolo[1,5-a]pyrimidin-7-yl)amino]methyl]phenyl]benzonitrile CAS Name: 2-[4-[[(5-methoxy-7-pyrazolo[1,5-a]pyrimidinyl)amino]methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[[(5-methoxypyrazolo[1,5-a]pyrimidin-7-yl)amino]methyl]phenyl]benzonitrile Traditional Name: 2-[4-[[(5-methoxypyrazolo[1,5-a]pyrimidin-7-yl)amino]methyl]phenyl]benzonitrile Formula: C21H17N5O MolecularWeight: 355.39258

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=CC=NN2C(=C1)NCC3=CC=C(C=C3)C4=CC=CC=C4C#N

Isomeric SMILES

COC1=NC2=CC=NN2C(=C1)NCC3=CC=C(C=C3)C4=CC=CC=C4C#N

InChI

InChI=1S/C21H17N5O/c1-27-21-12-20(26-19(25-21)10-11-24-26)23-14-15-6-8-16(9-7-15)18-5-3-2-4-17(18)13-22/h2-12,23H,14H2,1H3