N2-(3-methylbutyl)-5-nitro-6-piperidin-1-yl-pyrimidine-2,4-diamine

Systemtic Name: N2-(3-methylbutyl)-5-nitro-6-piperidin-1-yl-pyrimidine-2,4-diamine Openeye Name: N2-isopentyl-5-nitro-6-(1-piperidyl)pyrimidine-2,4-diamine CAS Name: N2-(3-methylbutyl)-5-nitro-6-(1-piperidinyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-(3-methylbutyl)-5-nitro-6-piperidin-1-ylpyrimidine-2,4-diamine Traditional Name: (4-amino-5-nitro-6-piperidino-pyrimidin-2-yl)-isoamyl-amine Formula: C14H24N6O2 MolecularWeight: 308.37936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCCCC2

Isomeric SMILES

CC(C)CCNC1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCCCC2

InChI

InChI=1S/C14H24N6O2/c1-10(2)6-7-16-14-17-12(15)11(20(21)22)13(18-14)19-8-4-3-5-9-19/h10H,3-9H2,1-2H3,(H3,15,16,17,18)