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

Systemtic Name: 2-cyclopropyl-6-phenyl-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride Openeye Name: 2-cyclopropyl-6-phenyl-4-(1-piperidyl)-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride CAS Name: 2-cyclopropyl-6-phenyl-4-(1-piperidinyl)-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride IUPAC Name: 2-cyclopropyl-6-phenyl-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride Traditional Name: 2-cyclopropyl-6-phenyl-4-piperidino-5H-pyrrolo[3,2-d]pyrimidin-5-ium chloride Formula: C20H23ClN4 MolecularWeight: 354.87642

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=NC3=C2[NH2+]C(=C3)C4=CC=CC=C4)C5CC5.[Cl-]

Isomeric SMILES

C1CCN(CC1)C2=NC(=NC3=C2[NH2+]C(=C3)C4=CC=CC=C4)C5CC5.[Cl-]

InChI

InChI=1S/C20H22N4.ClH/c1-3-7-14(8-4-1)16-13-17-18(21-16)20(24-11-5-2-6-12-24)23-19(22-17)15-9-10-15;/h1,3-4,7-8,13,15,21H,2,5-6,9-12H2;1H