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

Systemtic Name: 6-(benzotriazol-1-yl)-5-nitro-N-propan-2-yl-pyrimidin-4-amine Openeye Name: 6-(benzotriazol-1-yl)-N-isopropyl-5-nitro-pyrimidin-4-amine CAS Name: 6-(1-benzotriazolyl)-5-nitro-N-propan-2-yl-4-pyrimidinamine IUPAC Name: 6-(benzotriazol-1-yl)-5-nitro-N-propan-2-ylpyrimidin-4-amine Traditional Name: [6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]-isopropyl-amine Formula: C13H13N7O2 MolecularWeight: 299.28802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C13H13N7O2/c1-8(2)16-12-11(20(21)22)13(15-7-14-12)19-10-6-4-3-5-9(10)17-18-19/h3-8H,1-2H3,(H,14,15,16)