6-(benzotriazol-1-yl)-5-nitro-N-(phenylmethyl)-N-pyridin-2-yl-pyrimidin-4-amine

Systemtic Name: 6-(benzotriazol-1-yl)-5-nitro-N-(phenylmethyl)-N-pyridin-2-yl-pyrimidin-4-amine Openeye Name: 6-(benzotriazol-1-yl)-N-benzyl-5-nitro-N-(2-pyridyl)pyrimidin-4-amine CAS Name: 6-(1-benzotriazolyl)-5-nitro-N-(phenylmethyl)-N-(2-pyridinyl)-4-pyrimidinamine IUPAC Name: 6-(benzotriazol-1-yl)-N-benzyl-5-nitro-N-pyridin-2-ylpyrimidin-4-amine Traditional Name: [6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]-benzyl-(2-pyridyl)amine Formula: C22H16N8O2 MolecularWeight: 424.41484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=CC=N2)C3=NC=NC(=C3[N+](=O)[O-])N4C5=CC=CC=C5N=N4

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=CC=N2)C3=NC=NC(=C3[N+](=O)[O-])N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C22H16N8O2/c31-30(32)20-21(24-15-25-22(20)29-18-11-5-4-10-17(18)26-27-29)28(19-12-6-7-13-23-19)14-16-8-2-1-3-9-16/h1-13,15H,14H2