4-(3,5-dimethylpyrazol-1-yl)-6-(4-nitrophenoxy)-2-phenyl-pyrimidine

Systemtic Name: 4-(3,5-dimethylpyrazol-1-yl)-6-(4-nitrophenoxy)-2-phenyl-pyrimidine Openeye Name: 4-(3,5-dimethylpyrazol-1-yl)-6-(4-nitrophenoxy)-2-phenyl-pyrimidine CAS Name: 4-(3,5-dimethyl-1-pyrazolyl)-6-(4-nitrophenoxy)-2-phenylpyrimidine IUPAC Name: 4-(3,5-dimethylpyrazol-1-yl)-6-(4-nitrophenoxy)-2-phenylpyrimidine Traditional Name: 4-(3,5-dimethylpyrazol-1-yl)-6-(4-nitrophenoxy)-2-phenyl-pyrimidine Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC(=NC(=N2)C3=CC=CC=C3)OC4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C2=CC(=NC(=N2)C3=CC=CC=C3)OC4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C21H17N5O3/c1-14-12-15(2)25(24-14)19-13-20(23-21(22-19)16-6-4-3-5-7-16)29-18-10-8-17(9-11-18)26(27)28/h3-13H,1-2H3