4-[2-azanyl-9-(phenylmethyl)purin-6-yl]-2-methyl-but-3-yn-2-ol

Systemtic Name: 4-[2-azanyl-9-(phenylmethyl)purin-6-yl]-2-methyl-but-3-yn-2-ol Openeye Name: 4-(2-amino-9-benzyl-purin-6-yl)-2-methyl-but-3-yn-2-ol CAS Name: 4-[2-amino-9-(phenylmethyl)-6-purinyl]-2-methyl-3-butyn-2-ol IUPAC Name: 4-(2-amino-9-benzylpurin-6-yl)-2-methylbut-3-yn-2-ol Traditional Name: 4-(2-amino-9-benzyl-purin-6-yl)-2-methyl-but-3-yn-2-ol Formula: C17H17N5O MolecularWeight: 307.34978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=C2C(=NC(=N1)N)N(C=N2)CC3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C#CC1=C2C(=NC(=N1)N)N(C=N2)CC3=CC=CC=C3)O

InChI

InChI=1S/C17H17N5O/c1-17(2,23)9-8-13-14-15(21-16(18)20-13)22(11-19-14)10-12-6-4-3-5-7-12/h3-7,11,23H,10H2,1-2H3,(H2,18,20,21)