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

Systemtic Name: N-(2,5-dimethoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-(2,5-dimethoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-amine CAS Name: N-(2,5-dimethoxyphenyl)-6-(3,5-dimethyl-1-pyrazolyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-(2,5-dimethoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)-5-nitropyrimidin-4-amine Traditional Name: (2,5-dimethoxyphenyl)-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]amine Formula: C17H18N6O4 MolecularWeight: 370.36262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N6O4/c1-10-7-11(2)22(21-10)17-15(23(24)25)16(18-9-19-17)20-13-8-12(26-3)5-6-14(13)27-4/h5-9H,1-4H3,(H,18,19,20)