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

Systemtic Name: 2-(azepan-1-yl)-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine Openeye Name: 2-(azepan-1-yl)-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine CAS Name: 2-(1-azepanyl)-5-nitro-6-(1-pyrrolidinyl)-4-pyrimidinamine IUPAC Name: 2-(azepan-1-yl)-5-nitro-6-pyrrolidin-1-ylpyrimidin-4-amine Traditional Name: [2-(azepan-1-yl)-5-nitro-6-pyrrolidino-pyrimidin-4-yl]amine Formula: C14H22N6O2 MolecularWeight: 306.36348

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=C(C(=N2)N)[N+](=O)[O-])N3CCCC3

Isomeric SMILES

C1CCCN(CC1)C2=NC(=C(C(=N2)N)[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C14H22N6O2/c15-12-11(20(21)22)13(18-7-5-6-8-18)17-14(16-12)19-9-3-1-2-4-10-19/h1-10H2,(H2,15,16,17)