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

Systemtic Name: 7-(4-bromophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 7-(4-bromophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 7-(4-bromophenyl)-N-[3-(4-morpholin-4-iumyl)propyl]-5-phenyl-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 7-(4-bromophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [7-(4-bromophenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]-(3-morpholin-4-ium-4-ylpropyl)amine Formula: C25H27BrN5O+ MolecularWeight: 493.41878

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC2=NC=NC3=C2C(=CN3C4=CC=C(C=C4)Br)C5=CC=CC=C5

Isomeric SMILES

C1COCC[NH+]1CCCNC2=NC=NC3=C2C(=CN3C4=CC=C(C=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C25H26BrN5O/c26-20-7-9-21(10-8-20)31-17-22(19-5-2-1-3-6-19)23-24(28-18-29-25(23)31)27-11-4-12-30-13-15-32-16-14-30/h1-3,5-10,17-18H,4,11-16H2,(H,27,28,29)/p+1