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

Systemtic Name: N-[4-azanyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(2-pyridin-3-ylethyl)ethanamide Openeye Name: N-[4-amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-[2-(3-pyridyl)ethyl]acetamide CAS Name: N-[4-amino-5-(4-phenoxyphenyl)-7-pyrrolo[2,3-d]pyrimidinyl]-N-[2-(3-pyridinyl)ethyl]acetamide IUPAC Name: N-[4-amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(2-pyridin-3-ylethyl)acetamide Traditional Name: N-[4-amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-[2-(3-pyridyl)ethyl]acetamide Formula: C27H24N6O2 MolecularWeight: 464.51846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CCC1=CN=CC=C1)N2C=C(C3=C2N=CN=C3N)C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC(=O)N(CCC1=CN=CC=C1)N2C=C(C3=C2N=CN=C3N)C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C27H24N6O2/c1-19(34)32(15-13-20-6-5-14-29-16-20)33-17-24(25-26(28)30-18-31-27(25)33)21-9-11-23(12-10-21)35-22-7-3-2-4-8-22/h2-12,14,16-18H,13,15H2,1H3,(H2,28,30,31)