6-(3,5-dimethylpyrazol-1-yl)-5-nitro-N-(4-propan-2-ylphenyl)pyrimidin-4-amine

Systemtic Name: 6-(3,5-dimethylpyrazol-1-yl)-5-nitro-N-(4-propan-2-ylphenyl)pyrimidin-4-amine Openeye Name: 6-(3,5-dimethylpyrazol-1-yl)-N-(4-isopropylphenyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-(3,5-dimethyl-1-pyrazolyl)-5-nitro-N-(4-propan-2-ylphenyl)-4-pyrimidinamine IUPAC Name: 6-(3,5-dimethylpyrazol-1-yl)-5-nitro-N-(4-propan-2-ylphenyl)pyrimidin-4-amine Traditional Name: [6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]-p-cumenyl-amine Formula: C18H20N6O2 MolecularWeight: 352.3904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=C(C(=NC=N2)NC3=CC=C(C=C3)C(C)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C2=C(C(=NC=N2)NC3=CC=C(C=C3)C(C)C)[N+](=O)[O-])C

InChI

InChI=1S/C18H20N6O2/c1-11(2)14-5-7-15(8-6-14)21-17-16(24(25)26)18(20-10-19-17)23-13(4)9-12(3)22-23/h5-11H,1-4H3,(H,19,20,21)