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2-(1-adamantyl)-6-azanyl-9-(phenylmethyl)-7H-purin-8-one

2-(1-adamantyl)-6-azanyl-9-(phenylmethyl)-7H-purin-8-one

Systemtic Name:2-(1-adamantyl)-6-azanyl-9-(phenylmethyl)-7H-purin-8-one
Openeye Name:2-(1-adamantyl)-6-amino-9-benzyl-7H-purin-8-one
CAS Name:2-(1-adamantyl)-6-amino-9-(phenylmethyl)-7H-purin-8-one
IUPAC Name:2-(1-adamantyl)-6-amino-9-benzyl-7H-purin-8-one
Traditional Name:2-(1-adamantyl)-6-amino-9-benzyl-7H-purin-8-one
Formula: C22H25N5O
MolecularWeight: 375.4668
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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NC5=C(C(=N4)N)NC(=O)N5CC6=CC=CC=C6


Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NC5=C(C(=N4)N)NC(=O)N5CC6=CC=CC=C6


InChI

InChI=1S/C22H25N5O/c23-18-17-19(27(21(28)24-17)12-13-4-2-1-3-5-13)26-20(25-18)22-9-14-6-15(10-22)8-16(7-14)11-22/h1-5,14-16H,6-12H2,(H,24,28)(H2,23,25,26)


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