1-[3-[4-[3-[5-cyano-2,4-bis(oxidanylidene)pyrimidin-1-yl]propyl]piperazine-1,4-diium-1-yl]propyl]-2,4-bis(oxidanylidene)pyrimidine-5-carbonitrile

Systemtic Name: 1-[3-[4-[3-[5-cyano-2,4-bis(oxidanylidene)pyrimidin-1-yl]propyl]piperazine-1,4-diium-1-yl]propyl]-2,4-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 1-[3-[4-[3-(5-cyano-2,4-dioxo-pyrimidin-1-yl)propyl]piperazine-1,4-diium-1-yl]propyl]-2,4-dioxo-pyrimidine-5-carbonitrile CAS Name: 1-[3-[4-[3-(5-cyano-2,4-dioxo-1-pyrimidinyl)propyl]-1-piperazine-1,4-diiumyl]propyl]-2,4-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 1-[3-[4-[3-(5-cyano-2,4-dioxopyrimidin-1-yl)propyl]piperazine-1,4-diium-1-yl]propyl]-2,4-dioxopyrimidine-5-carbonitrile Traditional Name: 1-[3-[4-[3-(5-cyano-2,4-diketo-pyrimidin-1-yl)propyl]piperazine-1,4-diium-1-yl]propyl]-2,4-diketo-pyrimidine-5-carbonitrile Formula: C20H26N8O4+2 MolecularWeight: 442.47164

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCCN2C=C(C(=O)NC2=O)C#N)CCCN3C=C(C(=O)NC3=O)C#N

Isomeric SMILES

C1C[NH+](CC[NH+]1CCCN2C=C(C(=O)NC2=O)C#N)CCCN3C=C(C(=O)NC3=O)C#N

InChI

InChI=1S/C20H24N8O4/c21-11-15-13-27(19(31)23-17(15)29)5-1-3-25-7-9-26(10-8-25)4-2-6-28-14-16(12-22)18(30)24-20(28)32/h13-14H,1-10H2,(H,23,29,31)(H,24,30,32)/p+2