7-(4-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 7-(4-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 7-(4-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 7-(4-methoxyphenyl)-N-[3-(4-morpholin-4-iumyl)propyl]-5-phenyl-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 7-(4-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [7-(4-methoxyphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]-(3-morpholin-4-ium-4-ylpropyl)amine Formula: C26H30N5O2+ MolecularWeight: 444.5487

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3NCCC[NH+]4CCOCC4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3NCCC[NH+]4CCOCC4)C5=CC=CC=C5

InChI

InChI=1S/C26H29N5O2/c1-32-22-10-8-21(9-11-22)31-18-23(20-6-3-2-4-7-20)24-25(28-19-29-26(24)31)27-12-5-13-30-14-16-33-17-15-30/h2-4,6-11,18-19H,5,12-17H2,1H3,(H,27,28,29)/p+1