3-[6-azanyl-8-(furan-2-yl)-9-methyl-purin-2-yl]-N-propan-2-yl-prop-2-ynamide

Systemtic Name: 3-[6-azanyl-8-(furan-2-yl)-9-methyl-purin-2-yl]-N-propan-2-yl-prop-2-ynamide Openeye Name: 3-[6-amino-8-(2-furyl)-9-methyl-purin-2-yl]-N-isopropyl-prop-2-ynamide CAS Name: 3-[6-amino-8-(2-furanyl)-9-methyl-2-purinyl]-N-propan-2-yl-2-propynamide IUPAC Name: 3-[6-amino-8-(furan-2-yl)-9-methylpurin-2-yl]-N-propan-2-ylprop-2-ynamide Traditional Name: 3-[6-amino-8-(2-furyl)-9-methyl-purin-2-yl]-N-isopropyl-propiolamide Formula: C16H16N6O2 MolecularWeight: 324.33724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C#CC1=NC2=C(C(=N1)N)N=C(N2C)C3=CC=CO3

Isomeric SMILES

CC(C)NC(=O)C#CC1=NC2=C(C(=N1)N)N=C(N2C)C3=CC=CO3

InChI

InChI=1S/C16H16N6O2/c1-9(2)18-12(23)7-6-11-19-14(17)13-16(20-11)22(3)15(21-13)10-5-4-8-24-10/h4-5,8-9H,1-3H3,(H,18,23)(H2,17,19,20)