N-(4-morpholin-4-ylphenyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine

Systemtic Name: N-(4-morpholin-4-ylphenyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine Openeye Name: N-(4-morpholinophenyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine CAS Name: N-[4-(4-morpholinyl)phenyl]-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-2-pyrimidinamine IUPAC Name: N-(4-morpholin-4-ylphenyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine Traditional Name: (4-morpholinophenyl)-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-yl]amine Formula: C21H20N6O MolecularWeight: 372.4231

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CNC5=C4C=CC=N5

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CNC5=C4C=CC=N5

InChI

InChI=1S/C21H20N6O/c1-2-17-18(14-24-20(17)22-8-1)19-7-9-23-21(26-19)25-15-3-5-16(6-4-15)27-10-12-28-13-11-27/h1-9,14H,10-13H2,(H,22,24)(H,23,25,26)