4-[7-ethyl-3-methyl-2,6-bis(oxidanylidene)purin-8-yl]piperazine-1-carbaldehyde

Systemtic Name: 4-[7-ethyl-3-methyl-2,6-bis(oxidanylidene)purin-8-yl]piperazine-1-carbaldehyde Openeye Name: 4-(7-ethyl-3-methyl-2,6-dioxo-purin-8-yl)piperazine-1-carbaldehyde CAS Name: 4-(7-ethyl-3-methyl-2,6-dioxo-8-purinyl)-1-piperazinecarboxaldehyde IUPAC Name: 4-(7-ethyl-3-methyl-2,6-dioxopurin-8-yl)piperazine-1-carbaldehyde Traditional Name: 4-(7-ethyl-2,6-diketo-3-methyl-purin-8-yl)piperazine-1-carbaldehyde Formula: C13H18N6O3 MolecularWeight: 306.32042

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(N=C1N3CCN(CC3)C=O)N(C(=O)NC2=O)C

Isomeric SMILES

CCN1C2=C(N=C1N3CCN(CC3)C=O)N(C(=O)NC2=O)C

InChI

InChI=1S/C13H18N6O3/c1-3-19-9-10(16(2)13(22)15-11(9)21)14-12(19)18-6-4-17(8-20)5-7-18/h8H,3-7H2,1-2H3,(H,15,21,22)