6-(azepan-1-yl)-N-(2-morpholin-4-ylethyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(azepan-1-yl)-N-(2-morpholin-4-ylethyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(azepan-1-yl)-N-(2-morpholinoethyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-(1-azepanyl)-N-[2-(4-morpholinyl)ethyl]-5-nitro-4-pyrimidinamine IUPAC Name: 6-(azepan-1-yl)-N-(2-morpholin-4-ylethyl)-5-nitropyrimidin-4-amine Traditional Name: [6-(azepan-1-yl)-5-nitro-pyrimidin-4-yl]-(2-morpholinoethyl)amine Formula: C16H26N6O3 MolecularWeight: 350.41604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C(=NC=N2)NCCN3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C(=NC=N2)NCCN3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H26N6O3/c23-22(24)14-15(17-5-8-20-9-11-25-12-10-20)18-13-19-16(14)21-6-3-1-2-4-7-21/h13H,1-12H2,(H,17,18,19)