6-(azepan-1-yl)-N-ethyl-5-nitro-N-phenyl-pyrimidin-4-amine

Systemtic Name: 6-(azepan-1-yl)-N-ethyl-5-nitro-N-phenyl-pyrimidin-4-amine Openeye Name: 6-(azepan-1-yl)-N-ethyl-5-nitro-N-phenyl-pyrimidin-4-amine CAS Name: 6-(1-azepanyl)-N-ethyl-5-nitro-N-phenyl-4-pyrimidinamine IUPAC Name: 6-(azepan-1-yl)-N-ethyl-5-nitro-N-phenylpyrimidin-4-amine Traditional Name: [6-(azepan-1-yl)-5-nitro-pyrimidin-4-yl]-ethyl-phenyl-amine Formula: C18H23N5O2 MolecularWeight: 341.40752

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCCCCC3

Isomeric SMILES

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCCCCC3

InChI

InChI=1S/C18H23N5O2/c1-2-22(15-10-6-5-7-11-15)18-16(23(24)25)17(19-14-20-18)21-12-8-3-4-9-13-21/h5-7,10-11,14H,2-4,8-9,12-13H2,1H3