4-[3-(6-azanyl-9-cyclopentyl-purin-2-yl)prop-2-ynyl]-N-ethyl-N-methyl-piperazine-1-carboxamide

Systemtic Name: 4-[3-(6-azanyl-9-cyclopentyl-purin-2-yl)prop-2-ynyl]-N-ethyl-N-methyl-piperazine-1-carboxamide Openeye Name: 4-[3-(6-amino-9-cyclopentyl-purin-2-yl)prop-2-ynyl]-N-ethyl-N-methyl-piperazine-1-carboxamide CAS Name: 4-[3-(6-amino-9-cyclopentyl-2-purinyl)prop-2-ynyl]-N-ethyl-N-methyl-1-piperazinecarboxamide IUPAC Name: 4-[3-(6-amino-9-cyclopentylpurin-2-yl)prop-2-ynyl]-N-ethyl-N-methylpiperazine-1-carboxamide Traditional Name: 4-[3-(6-amino-9-cyclopentyl-purin-2-yl)prop-2-ynyl]-N-ethyl-N-methyl-piperazine-1-carboxamide Formula: C21H30N8O MolecularWeight: 410.5159

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C(=O)N1CCN(CC1)CC#CC2=NC3=C(C(=N2)N)N=CN3C4CCCC4

Isomeric SMILES

CCN(C)C(=O)N1CCN(CC1)CC#CC2=NC3=C(C(=N2)N)N=CN3C4CCCC4

InChI

InChI=1S/C21H30N8O/c1-3-26(2)21(30)28-13-11-27(12-14-28)10-6-9-17-24-19(22)18-20(25-17)29(15-23-18)16-7-4-5-8-16/h15-16H,3-5,7-8,10-14H2,1-2H3,(H2,22,24,25)