2,4-bis(chloranyl)-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide Openeye Name: 2,4-dichloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide CAS Name: 2,4-dichloro-N-[4-cyano-2-(4,6-dimethyl-2-pyrimidinyl)-3-pyrazolyl]benzamide IUPAC Name: 2,4-dichloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide Traditional Name: 2,4-dichloro-N-[4-cyano-2-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-yl]benzamide Formula: C17H12Cl2N6O MolecularWeight: 387.22278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C(=C(C=N2)C#N)NC(=O)C3=C(C=C(C=C3)Cl)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C(=C(C=N2)C#N)NC(=O)C3=C(C=C(C=C3)Cl)Cl)C

InChI

InChI=1S/C17H12Cl2N6O/c1-9-5-10(2)23-17(22-9)25-15(11(7-20)8-21-25)24-16(26)13-4-3-12(18)6-14(13)19/h3-6,8H,1-2H3,(H,24,26)