2-[4-[4-(oxolan-2-ylmethylamino)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[4-(oxolan-2-ylmethylamino)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenoxy]ethanenitrile Openeye Name: 2-[4-[5-phenyl-4-(tetrahydrofuran-2-ylmethylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenoxy]acetonitrile CAS Name: 2-[4-[4-(2-oxolanylmethylamino)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenoxy]acetonitrile IUPAC Name: 2-[4-[4-(oxolan-2-ylmethylamino)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenoxy]acetonitrile Traditional Name: 2-[4-[5-phenyl-4-(tetrahydrofurfurylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenoxy]acetonitrile Formula: C25H23N5O2 MolecularWeight: 425.48242

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=NC=NC3=C2C(=C(N3)C4=CC=C(C=C4)OCC#N)C5=CC=CC=C5

Isomeric SMILES

C1CC(OC1)CNC2=NC=NC3=C2C(=C(N3)C4=CC=C(C=C4)OCC#N)C5=CC=CC=C5

InChI

InChI=1S/C25H23N5O2/c26-12-14-32-19-10-8-18(9-11-19)23-21(17-5-2-1-3-6-17)22-24(28-16-29-25(22)30-23)27-15-20-7-4-13-31-20/h1-3,5-6,8-11,16,20H,4,7,13-15H2,(H2,27,28,29,30)