N-butyl-5-nitro-6-piperidin-1-yl-pyrimidin-4-amine

Systemtic Name: N-butyl-5-nitro-6-piperidin-1-yl-pyrimidin-4-amine Openeye Name: N-butyl-5-nitro-6-(1-piperidyl)pyrimidin-4-amine CAS Name: N-butyl-5-nitro-6-(1-piperidinyl)-4-pyrimidinamine IUPAC Name: N-butyl-5-nitro-6-piperidin-1-ylpyrimidin-4-amine Traditional Name: butyl-(5-nitro-6-piperidino-pyrimidin-4-yl)amine Formula: C13H21N5O2 MolecularWeight: 279.33814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=NC(=C1[N+](=O)[O-])N2CCCCC2

Isomeric SMILES

CCCCNC1=NC=NC(=C1[N+](=O)[O-])N2CCCCC2

InChI

InChI=1S/C13H21N5O2/c1-2-3-7-14-12-11(18(19)20)13(16-10-15-12)17-8-5-4-6-9-17/h10H,2-9H2,1H3,(H,14,15,16)