2-[4-azanyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(1-oxidanylpropan-2-yl)ethanamide

Systemtic Name: 2-[4-azanyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(1-oxidanylpropan-2-yl)ethanamide Openeye Name: 2-[4-amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(2-hydroxy-1-methyl-ethyl)acetamide CAS Name: 2-[4-amino-5-(4-phenoxyphenyl)-7-pyrrolo[2,3-d]pyrimidinyl]-N-(1-hydroxypropan-2-yl)acetamide IUPAC Name: 2-[4-amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(1-hydroxypropan-2-yl)acetamide Traditional Name: 2-[4-amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(2-hydroxy-1-methyl-ethyl)acetamide Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)NC(=O)CN1C=C(C2=C1N=CN=C2N)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC(CO)NC(=O)CN1C=C(C2=C1N=CN=C2N)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C23H23N5O3/c1-15(13-29)27-20(30)12-28-11-19(21-22(24)25-14-26-23(21)28)16-7-9-18(10-8-16)31-17-5-3-2-4-6-17/h2-11,14-15,29H,12-13H2,1H3,(H,27,30)(H2,24,25,26)