6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-N-pyridin-4-yl-pyrimidin-4-amine

Systemtic Name: 6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-N-pyridin-4-yl-pyrimidin-4-amine Openeye Name: 6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-N-(4-pyridyl)pyrimidin-4-amine CAS Name: 6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-N-pyridin-4-yl-4-pyrimidinamine IUPAC Name: 6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-N-pyridin-4-ylpyrimidin-4-amine Traditional Name: [6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-pyrimidin-4-yl]-(4-pyridyl)amine Formula: C18H16N6O2 MolecularWeight: 348.35864

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C(=NC=N3)NC4=CC=NC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C(=NC=N3)NC4=CC=NC=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H16N6O2/c25-24(26)16-17(22-15-5-8-19-9-6-15)20-12-21-18(16)23-10-7-13-3-1-2-4-14(13)11-23/h1-6,8-9,12H,7,10-11H2,(H,19,20,21,22)