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

Systemtic Name: 6-(3,4-dihydro-1H-isoquinolin-2-yl)-N-ethyl-5-nitro-N-phenyl-pyrimidin-4-amine Openeye Name: 6-(3,4-dihydro-1H-isoquinolin-2-yl)-N-ethyl-5-nitro-N-phenyl-pyrimidin-4-amine CAS Name: 6-(3,4-dihydro-1H-isoquinolin-2-yl)-N-ethyl-5-nitro-N-phenyl-4-pyrimidinamine IUPAC Name: 6-(3,4-dihydro-1H-isoquinolin-2-yl)-N-ethyl-5-nitro-N-phenylpyrimidin-4-amine Traditional Name: [6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-pyrimidin-4-yl]-ethyl-phenyl-amine Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H21N5O2/c1-2-25(18-10-4-3-5-11-18)21-19(26(27)28)20(22-15-23-21)24-13-12-16-8-6-7-9-17(16)14-24/h3-11,15H,2,12-14H2,1H3