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

Systemtic Name: 2-(azepan-1-yl)-6-morpholin-4-yl-5-nitro-pyrimidin-4-amine Openeye Name: 2-(azepan-1-yl)-6-morpholino-5-nitro-pyrimidin-4-amine CAS Name: 2-(1-azepanyl)-6-(4-morpholinyl)-5-nitro-4-pyrimidinamine IUPAC Name: 2-(azepan-1-yl)-6-morpholin-4-yl-5-nitropyrimidin-4-amine Traditional Name: [2-(azepan-1-yl)-6-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=NC(=C(C(=N2)N)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

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

InChI

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