N-(2,4-dimethoxyphenyl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine

Systemtic Name: N-(2,4-dimethoxyphenyl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine Openeye Name: N-(2,4-dimethoxyphenyl)-6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-amine CAS Name: N-(2,4-dimethoxyphenyl)-5-nitro-6-(4-propan-2-ylphenoxy)-4-pyrimidinamine IUPAC Name: N-(2,4-dimethoxyphenyl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine Traditional Name: (2,4-dimethoxyphenyl)-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C21H22N4O5 MolecularWeight: 410.42318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C21H22N4O5/c1-13(2)14-5-7-15(8-6-14)30-21-19(25(26)27)20(22-12-23-21)24-17-10-9-16(28-3)11-18(17)29-4/h5-13H,1-4H3,(H,22,23,24)