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

Systemtic Name: 3-[cyclohexyl-(5-nitro-6-piperidin-1-yl-pyrimidin-4-yl)amino]propanenitrile Openeye Name: 3-[cyclohexyl-[5-nitro-6-(1-piperidyl)pyrimidin-4-yl]amino]propanenitrile CAS Name: 3-[cyclohexyl-[5-nitro-6-(1-piperidinyl)-4-pyrimidinyl]amino]propanenitrile IUPAC Name: 3-[cyclohexyl-(5-nitro-6-piperidin-1-ylpyrimidin-4-yl)amino]propanenitrile Traditional Name: 3-[cyclohexyl-(5-nitro-6-piperidino-pyrimidin-4-yl)amino]propionitrile Formula: C18H26N6O2 MolecularWeight: 358.43804

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CCC#N)C2=NC=NC(=C2[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

C1CCC(CC1)N(CCC#N)C2=NC=NC(=C2[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C18H26N6O2/c19-10-7-13-23(15-8-3-1-4-9-15)18-16(24(25)26)17(20-14-21-18)22-11-5-2-6-12-22/h14-15H,1-9,11-13H2