6-chloranyl-8-(2-diethoxyphosphoryl-3-methyl-imidazol-4-yl)-9-(2,2-dimethylpropyl)purine

Systemtic Name: 6-chloranyl-8-(2-diethoxyphosphoryl-3-methyl-imidazol-4-yl)-9-(2,2-dimethylpropyl)purine Openeye Name: 6-chloro-8-(2-diethoxyphosphoryl-3-methyl-imidazol-4-yl)-9-(2,2-dimethylpropyl)purine CAS Name: 6-chloro-8-(2-diethoxyphosphoryl-3-methyl-4-imidazolyl)-9-(2,2-dimethylpropyl)purine IUPAC Name: 6-chloro-8-(2-diethoxyphosphoryl-3-methylimidazol-4-yl)-9-(2,2-dimethylpropyl)purine Traditional Name: 6-chloro-8-(2-diethoxyphosphoryl-3-methyl-imidazol-4-yl)-9-neopentyl-purine Formula: C18H26ClN6O3P MolecularWeight: 440.864201

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=NC=C(N1C)C2=NC3=C(N2CC(C)(C)C)N=CN=C3Cl)OCC

Isomeric SMILES

CCOP(=O)(C1=NC=C(N1C)C2=NC3=C(N2CC(C)(C)C)N=CN=C3Cl)OCC

InChI

InChI=1S/C18H26ClN6O3P/c1-7-27-29(26,28-8-2)17-20-9-12(24(17)6)15-23-13-14(19)21-11-22-16(13)25(15)10-18(3,4)5/h9,11H,7-8,10H2,1-6H3