6-(azepan-1-yl)-N,N-bis(2-methylpropyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(azepan-1-yl)-N,N-bis(2-methylpropyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(azepan-1-yl)-N,N-diisobutyl-5-nitro-pyrimidin-4-amine CAS Name: 6-(1-azepanyl)-N,N-bis(2-methylpropyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(azepan-1-yl)-N,N-bis(2-methylpropyl)-5-nitropyrimidin-4-amine Traditional Name: [6-(azepan-1-yl)-5-nitro-pyrimidin-4-yl]-diisobutyl-amine Formula: C18H31N5O2 MolecularWeight: 349.47104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C1=NC=NC(=C1[N+](=O)[O-])N2CCCCCC2

Isomeric SMILES

CC(C)CN(CC(C)C)C1=NC=NC(=C1[N+](=O)[O-])N2CCCCCC2

InChI

InChI=1S/C18H31N5O2/c1-14(2)11-22(12-15(3)4)18-16(23(24)25)17(19-13-20-18)21-9-7-5-6-8-10-21/h13-15H,5-12H2,1-4H3