3-[2-cyanoethyl-(5-nitro-6-piperidin-1-yl-pyrimidin-4-yl)amino]propanenitrile

Systemtic Name: 3-[2-cyanoethyl-(5-nitro-6-piperidin-1-yl-pyrimidin-4-yl)amino]propanenitrile Openeye Name: 3-[2-cyanoethyl-[5-nitro-6-(1-piperidyl)pyrimidin-4-yl]amino]propanenitrile CAS Name: 3-[2-cyanoethyl-[5-nitro-6-(1-piperidinyl)-4-pyrimidinyl]amino]propanenitrile IUPAC Name: 3-[2-cyanoethyl-(5-nitro-6-piperidin-1-ylpyrimidin-4-yl)amino]propanenitrile Traditional Name: 3-[2-cyanoethyl-(5-nitro-6-piperidino-pyrimidin-4-yl)amino]propionitrile Formula: C15H19N7O2 MolecularWeight: 329.35706

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=NC=N2)N(CCC#N)CCC#N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C(=NC=N2)N(CCC#N)CCC#N)[N+](=O)[O-]

InChI

InChI=1S/C15H19N7O2/c16-6-4-10-21(11-5-7-17)15-13(22(23)24)14(18-12-19-15)20-8-2-1-3-9-20/h12H,1-5,8-11H2