N-(4-methylpiperazin-1-yl)-5-nitro-6-pyridin-3-yloxy-pyrimidin-4-amine

Systemtic Name: N-(4-methylpiperazin-1-yl)-5-nitro-6-pyridin-3-yloxy-pyrimidin-4-amine Openeye Name: N-(4-methylpiperazin-1-yl)-5-nitro-6-(3-pyridyloxy)pyrimidin-4-amine CAS Name: N-(4-methyl-1-piperazinyl)-5-nitro-6-(3-pyridinyloxy)-4-pyrimidinamine IUPAC Name: N-(4-methylpiperazin-1-yl)-5-nitro-6-pyridin-3-yloxypyrimidin-4-amine Traditional Name: (4-methylpiperazino)-[5-nitro-6-(3-pyridyloxy)pyrimidin-4-yl]amine Formula: C14H17N7O3 MolecularWeight: 331.32988

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC2=C(C(=NC=N2)OC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)NC2=C(C(=NC=N2)OC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H17N7O3/c1-19-5-7-20(8-6-19)18-13-12(21(22)23)14(17-10-16-13)24-11-3-2-4-15-9-11/h2-4,9-10H,5-8H2,1H3,(H,16,17,18)