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

Systemtic Name: 3-[8-(cyclohexylamino)-3-methyl-2,6-bis(oxidanylidene)purin-7-yl]propanenitrile Openeye Name: 3-[8-(cyclohexylamino)-3-methyl-2,6-dioxo-purin-7-yl]propanenitrile CAS Name: 3-[8-(cyclohexylamino)-3-methyl-2,6-dioxo-7-purinyl]propanenitrile IUPAC Name: 3-[8-(cyclohexylamino)-3-methyl-2,6-dioxopurin-7-yl]propanenitrile Traditional Name: 3-[8-(cyclohexylamino)-2,6-diketo-3-methyl-purin-7-yl]propionitrile Formula: C15H20N6O2 MolecularWeight: 316.3583

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)NC3CCCCC3)CCC#N

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)NC3CCCCC3)CCC#N

InChI

InChI=1S/C15H20N6O2/c1-20-12-11(13(22)19-15(20)23)21(9-5-8-16)14(18-12)17-10-6-3-2-4-7-10/h10H,2-7,9H2,1H3,(H,17,18)(H,19,22,23)