[5-chloranyl-6-[3-methyl-4-(7H-purin-6-yl)piperazin-1-yl]pyridin-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [5-chloranyl-6-[3-methyl-4-(7H-purin-6-yl)piperazin-1-yl]pyridin-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [5-chloro-6-[3-methyl-4-(7H-purin-6-yl)piperazin-1-yl]-3-pyridyl]-pyrrolidin-1-yl-methanone CAS Name: [5-chloro-6-[3-methyl-4-(7H-purin-6-yl)-1-piperazinyl]-3-pyridinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [5-chloro-6-[3-methyl-4-(7H-purin-6-yl)piperazin-1-yl]pyridin-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [5-chloro-6-[3-methyl-4-(7H-purin-6-yl)piperazino]-3-pyridyl]-pyrrolidino-methanone Formula: C20H23ClN8O MolecularWeight: 426.90262

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=NC=NC3=C2NC=N3)C4=C(C=C(C=N4)C(=O)N5CCCC5)Cl

Isomeric SMILES

CC1CN(CCN1C2=NC=NC3=C2NC=N3)C4=C(C=C(C=N4)C(=O)N5CCCC5)Cl

InChI

InChI=1S/C20H23ClN8O/c1-13-10-28(6-7-29(13)19-16-17(24-11-23-16)25-12-26-19)18-15(21)8-14(9-22-18)20(30)27-4-2-3-5-27/h8-9,11-13H,2-7,10H2,1H3,(H,23,24,25,26)