3-[6-azanyl-8-(furan-2-yl)-9-methyl-purin-2-yl]-1-phenyl-prop-2-yn-1-one

Systemtic Name: 3-[6-azanyl-8-(furan-2-yl)-9-methyl-purin-2-yl]-1-phenyl-prop-2-yn-1-one Openeye Name: 3-[6-amino-8-(2-furyl)-9-methyl-purin-2-yl]-1-phenyl-prop-2-yn-1-one CAS Name: 3-[6-amino-8-(2-furanyl)-9-methyl-2-purinyl]-1-phenyl-2-propyn-1-one IUPAC Name: 3-[6-amino-8-(furan-2-yl)-9-methylpurin-2-yl]-1-phenylprop-2-yn-1-one Traditional Name: 3-[6-amino-8-(2-furyl)-9-methyl-purin-2-yl]-1-phenyl-prop-2-yn-1-one Formula: C19H13N5O2 MolecularWeight: 343.33882

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC(=N2)C#CC(=O)C3=CC=CC=C3)N)N=C1C4=CC=CO4

Isomeric SMILES

CN1C2=C(C(=NC(=N2)C#CC(=O)C3=CC=CC=C3)N)N=C1C4=CC=CO4

InChI

InChI=1S/C19H13N5O2/c1-24-18(14-8-5-11-26-14)23-16-17(20)21-15(22-19(16)24)10-9-13(25)12-6-3-2-4-7-12/h2-8,11H,1H3,(H2,20,21,22)