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

Systemtic Name: 6-(azepan-1-yl)-2-morpholin-4-yl-5-nitro-pyrimidin-4-amine Openeye Name: 6-(azepan-1-yl)-2-morpholino-5-nitro-pyrimidin-4-amine CAS Name: 6-(1-azepanyl)-2-(4-morpholinyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(azepan-1-yl)-2-morpholin-4-yl-5-nitropyrimidin-4-amine Traditional Name: [6-(azepan-1-yl)-2-morpholino-5-nitro-pyrimidin-4-yl]amine Formula: C14H22N6O3 MolecularWeight: 322.36288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C(=NC(=N2)N3CCOCC3)N)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C(=NC(=N2)N3CCOCC3)N)[N+](=O)[O-]

InChI

InChI=1S/C14H22N6O3/c15-12-11(20(21)22)13(18-5-3-1-2-4-6-18)17-14(16-12)19-7-9-23-10-8-19/h1-10H2,(H2,15,16,17)