6-phenyl-4-piperidin-1-yl-N-propyl-5H-pyrrolo[3,2-d]pyrimidin-5-ium-2-amine chloride

Systemtic Name: 6-phenyl-4-piperidin-1-yl-N-propyl-5H-pyrrolo[3,2-d]pyrimidin-5-ium-2-amine chloride Openeye Name: 6-phenyl-4-(1-piperidyl)-N-propyl-5H-pyrrolo[3,2-d]pyrimidin-5-ium-2-amine chloride CAS Name: 6-phenyl-4-(1-piperidinyl)-N-propyl-5H-pyrrolo[3,2-d]pyrimidin-5-ium-2-amine chloride IUPAC Name: 6-phenyl-4-piperidin-1-yl-N-propyl-5H-pyrrolo[3,2-d]pyrimidin-5-ium-2-amine chloride Traditional Name: (6-phenyl-4-piperidino-5H-pyrrolo[3,2-d]pyrimidin-5-ium-2-yl)-propyl-amine chloride Formula: C20H26ClN5 MolecularWeight: 371.90694

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC2=C(C(=N1)N3CCCCC3)[NH2+]C(=C2)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

CCCNC1=NC2=C(C(=N1)N3CCCCC3)[NH2+]C(=C2)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C20H25N5.ClH/c1-2-11-21-20-23-17-14-16(15-9-5-3-6-10-15)22-18(17)19(24-20)25-12-7-4-8-13-25;/h3,5-6,9-10,14,22H,2,4,7-8,11-13H2,1H3,(H,21,23,24);1H