N-[4-[[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanamide

Systemtic Name: N-[4-[[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanamide Openeye Name: N-[4-[[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]amino]phenyl]acetamide CAS Name: N-[4-[[6-(3,5-dimethylphenoxy)-5-nitro-4-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: N-[4-[[6-(3,5-dimethylphenoxy)-5-nitropyrimidin-4-yl]amino]phenyl]acetamide Traditional Name: N-[4-[[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]amino]phenyl]acetamide Formula: C20H19N5O4 MolecularWeight: 393.39596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)NC(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)NC(=O)C)C

InChI

InChI=1S/C20H19N5O4/c1-12-8-13(2)10-17(9-12)29-20-18(25(27)28)19(21-11-22-20)24-16-6-4-15(5-7-16)23-14(3)26/h4-11H,1-3H3,(H,23,26)(H,21,22,24)