2-[4-azanyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(2-oxidanylbutyl)ethanamide

Systemtic Name: 2-[4-azanyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(2-oxidanylbutyl)ethanamide Openeye Name: 2-[4-amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(2-hydroxybutyl)acetamide CAS Name: 2-[4-amino-5-(4-phenoxyphenyl)-7-pyrrolo[2,3-d]pyrimidinyl]-N-(2-hydroxybutyl)acetamide IUPAC Name: 2-[4-amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(2-hydroxybutyl)acetamide Traditional Name: 2-[4-amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(2-hydroxybutyl)acetamide Formula: C24H25N5O3 MolecularWeight: 431.487

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)CN1C=C(C2=C1N=CN=C2N)C3=CC=C(C=C3)OC4=CC=CC=C4)O

Isomeric SMILES

CCC(CNC(=O)CN1C=C(C2=C1N=CN=C2N)C3=CC=C(C=C3)OC4=CC=CC=C4)O

InChI

InChI=1S/C24H25N5O3/c1-2-17(30)12-26-21(31)14-29-13-20(22-23(25)27-15-28-24(22)29)16-8-10-19(11-9-16)32-18-6-4-3-5-7-18/h3-11,13,15,17,30H,2,12,14H2,1H3,(H,26,31)(H2,25,27,28)