7-(4-chlorophenyl)-5-phenyl-N-(pyridin-1-ium-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 7-(4-chlorophenyl)-5-phenyl-N-(pyridin-1-ium-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 7-(4-chlorophenyl)-5-phenyl-N-(pyridin-1-ium-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 7-(4-chlorophenyl)-5-phenyl-N-(2-pyridin-1-iumylmethyl)-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 7-(4-chlorophenyl)-5-phenyl-N-(pyridin-1-ium-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [7-(4-chlorophenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]-(pyridin-1-ium-2-ylmethyl)amine Formula: C24H19ClN5+ MolecularWeight: 412.89416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C3=C2C(=NC=N3)NCC4=CC=CC=[NH+]4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C3=C2C(=NC=N3)NCC4=CC=CC=[NH+]4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C24H18ClN5/c25-18-9-11-20(12-10-18)30-15-21(17-6-2-1-3-7-17)22-23(28-16-29-24(22)30)27-14-19-8-4-5-13-26-19/h1-13,15-16H,14H2,(H,27,28,29)/p+1