[5-chloranyl-6-[4-(9-methylpurin-6-yl)piperazin-1-yl]pyridin-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [5-chloranyl-6-[4-(9-methylpurin-6-yl)piperazin-1-yl]pyridin-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [5-chloro-6-[4-(9-methylpurin-6-yl)piperazin-1-yl]-3-pyridyl]-pyrrolidin-1-yl-methanone CAS Name: [5-chloro-6-[4-(9-methyl-6-purinyl)-1-piperazinyl]-3-pyridinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [5-chloro-6-[4-(9-methylpurin-6-yl)piperazin-1-yl]pyridin-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [5-chloro-6-[4-(9-methylpurin-6-yl)piperazino]-3-pyridyl]-pyrrolidino-methanone Formula: C20H23ClN8O MolecularWeight: 426.90262

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1N=CN=C2N3CCN(CC3)C4=C(C=C(C=N4)C(=O)N5CCCC5)Cl

Isomeric SMILES

CN1C=NC2=C1N=CN=C2N3CCN(CC3)C4=C(C=C(C=N4)C(=O)N5CCCC5)Cl

InChI

InChI=1S/C20H23ClN8O/c1-26-13-25-16-18(26)23-12-24-19(16)28-8-6-27(7-9-28)17-15(21)10-14(11-22-17)20(30)29-4-2-3-5-29/h10-13H,2-9H2,1H3