8-(furan-2-yl)-2-(3-phenylpropoxy)-9-prop-2-ynyl-purin-6-amine

Systemtic Name: 8-(furan-2-yl)-2-(3-phenylpropoxy)-9-prop-2-ynyl-purin-6-amine Openeye Name: 8-(2-furyl)-2-(3-phenylpropoxy)-9-prop-2-ynyl-purin-6-amine CAS Name: 8-(2-furanyl)-2-(3-phenylpropoxy)-9-prop-2-ynyl-6-purinamine IUPAC Name: 8-(furan-2-yl)-2-(3-phenylpropoxy)-9-prop-2-ynylpurin-6-amine Traditional Name: [8-(2-furyl)-2-(3-phenylpropoxy)-9-propargyl-purin-6-yl]amine Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=C(C(=NC(=N2)OCCCC3=CC=CC=C3)N)N=C1C4=CC=CO4

Isomeric SMILES

C#CCN1C2=C(C(=NC(=N2)OCCCC3=CC=CC=C3)N)N=C1C4=CC=CO4

InChI

InChI=1S/C21H19N5O2/c1-2-12-26-19(16-11-7-13-27-16)23-17-18(22)24-21(25-20(17)26)28-14-6-10-15-8-4-3-5-9-15/h1,3-5,7-9,11,13H,6,10,12,14H2,(H2,22,24,25)