2-methyl-4-piperidin-1-yl-6-pyridin-2-yl-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride

Systemtic Name: 2-methyl-4-piperidin-1-yl-6-pyridin-2-yl-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride Openeye Name: 2-methyl-4-(1-piperidyl)-6-(2-pyridyl)-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride CAS Name: 2-methyl-4-(1-piperidinyl)-6-(2-pyridinyl)-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride IUPAC Name: 2-methyl-4-piperidin-1-yl-6-pyridin-2-yl-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride Traditional Name: 2-methyl-4-piperidino-6-(2-pyridyl)-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride Formula: C17H20ClN5 MolecularWeight: 329.8272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)N3CCCCC3)[NH2+]C(=C2)C4=CC=CC=N4.[Cl-]

Isomeric SMILES

CC1=NC2=C(C(=N1)N3CCCCC3)[NH2+]C(=C2)C4=CC=CC=N4.[Cl-]

InChI

InChI=1S/C17H19N5.ClH/c1-12-19-15-11-14(13-7-3-4-8-18-13)21-16(15)17(20-12)22-9-5-2-6-10-22;/h3-4,7-8,11,21H,2,5-6,9-10H2,1H3;1H