5,6-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-7-(pyridin-4-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 5,6-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-7-(pyridin-4-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 5,6-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-7-(4-pyridylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 5,6-dimethyl-N-[2-(4-morpholin-4-iumyl)ethyl]-7-(pyridin-4-ylmethyl)-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 5,6-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-7-(pyridin-4-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [5,6-dimethyl-7-(4-pyridylmethyl)pyrrolo[2,3-d]pyrimidin-4-yl]-(2-morpholin-4-ium-4-ylethyl)amine Formula: C20H27N6O+ MolecularWeight: 367.46798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=NC=N2)NCC[NH+]3CCOCC3)CC4=CC=NC=C4)C

Isomeric SMILES

CC1=C(N(C2=C1C(=NC=N2)NCC[NH+]3CCOCC3)CC4=CC=NC=C4)C

InChI

InChI=1S/C20H26N6O/c1-15-16(2)26(13-17-3-5-21-6-4-17)20-18(15)19(23-14-24-20)22-7-8-25-9-11-27-12-10-25/h3-6,14H,7-13H2,1-2H3,(H,22,23,24)/p+1