3-[7-(2-methoxyethyl)-8-methyl-2,6-bis(oxidanylidene)-3-propyl-purin-1-yl]propanenitrile

Systemtic Name: 3-[7-(2-methoxyethyl)-8-methyl-2,6-bis(oxidanylidene)-3-propyl-purin-1-yl]propanenitrile Openeye Name: 3-[7-(2-methoxyethyl)-8-methyl-2,6-dioxo-3-propyl-purin-1-yl]propanenitrile CAS Name: 3-[7-(2-methoxyethyl)-8-methyl-2,6-dioxo-3-propyl-1-purinyl]propanenitrile IUPAC Name: 3-[7-(2-methoxyethyl)-8-methyl-2,6-dioxo-3-propylpurin-1-yl]propanenitrile Traditional Name: 3-[2,6-diketo-7-(2-methoxyethyl)-8-methyl-3-propyl-purin-1-yl]propionitrile Formula: C15H21N5O3 MolecularWeight: 319.35894

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC#N)N(C(=N2)C)CCOC

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC#N)N(C(=N2)C)CCOC

InChI

InChI=1S/C15H21N5O3/c1-4-7-19-13-12(18(9-10-23-3)11(2)17-13)14(21)20(15(19)22)8-5-6-16/h4-5,7-10H2,1-3H3