5-nitro-N-(phenylmethyl)-N-pyridin-2-yl-6-pyridin-3-yloxy-pyrimidin-4-amine

Systemtic Name: 5-nitro-N-(phenylmethyl)-N-pyridin-2-yl-6-pyridin-3-yloxy-pyrimidin-4-amine Openeye Name: N-benzyl-5-nitro-N-(2-pyridyl)-6-(3-pyridyloxy)pyrimidin-4-amine CAS Name: 5-nitro-N-(phenylmethyl)-N-(2-pyridinyl)-6-(3-pyridinyloxy)-4-pyrimidinamine IUPAC Name: N-benzyl-5-nitro-N-pyridin-2-yl-6-pyridin-3-yloxypyrimidin-4-amine Traditional Name: benzyl-[5-nitro-6-(3-pyridyloxy)pyrimidin-4-yl]-(2-pyridyl)amine Formula: C21H16N6O3 MolecularWeight: 400.39014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=CC=N2)C3=C(C(=NC=N3)OC4=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=CC=N2)C3=C(C(=NC=N3)OC4=CN=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16N6O3/c28-27(29)19-20(24-15-25-21(19)30-17-9-6-11-22-13-17)26(18-10-4-5-12-23-18)14-16-7-2-1-3-8-16/h1-13,15H,14H2