3-[4-(5-nitro-6-piperidin-1-yl-pyrimidin-4-yl)piperazin-1-yl]pyrazine-2-carbonitrile

Systemtic Name: 3-[4-(5-nitro-6-piperidin-1-yl-pyrimidin-4-yl)piperazin-1-yl]pyrazine-2-carbonitrile Openeye Name: 3-[4-[5-nitro-6-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]pyrazine-2-carbonitrile CAS Name: 3-[4-[5-nitro-6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]-2-pyrazinecarbonitrile IUPAC Name: 3-[4-(5-nitro-6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]pyrazine-2-carbonitrile Traditional Name: 3-[4-(5-nitro-6-piperidino-pyrimidin-4-yl)piperazino]pyrazinonitrile Formula: C18H21N9O2 MolecularWeight: 395.41844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=NC=N2)N3CCN(CC3)C4=NC=CN=C4C#N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C(=NC=N2)N3CCN(CC3)C4=NC=CN=C4C#N)[N+](=O)[O-]

InChI

InChI=1S/C18H21N9O2/c19-12-14-16(21-5-4-20-14)25-8-10-26(11-9-25)18-15(27(28)29)17(22-13-23-18)24-6-2-1-3-7-24/h4-5,13H,1-3,6-11H2