2,5-bis(chloranyl)-N-[4-cyano-2-(4,8-dimethylquinolin-2-yl)pyrazol-3-yl]benzamide

Systemtic Name: 2,5-bis(chloranyl)-N-[4-cyano-2-(4,8-dimethylquinolin-2-yl)pyrazol-3-yl]benzamide Openeye Name: 2,5-dichloro-N-[4-cyano-2-(4,8-dimethyl-2-quinolyl)pyrazol-3-yl]benzamide CAS Name: 2,5-dichloro-N-[4-cyano-2-(4,8-dimethyl-2-quinolinyl)-3-pyrazolyl]benzamide IUPAC Name: 2,5-dichloro-N-[4-cyano-2-(4,8-dimethylquinolin-2-yl)pyrazol-3-yl]benzamide Traditional Name: 2,5-dichloro-N-[4-cyano-2-(4,8-dimethyl-2-quinolyl)pyrazol-3-yl]benzamide Formula: C22H15Cl2N5O MolecularWeight: 436.2934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)N3C(=C(C=N3)C#N)NC(=O)C4=C(C=CC(=C4)Cl)Cl

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)N3C(=C(C=N3)C#N)NC(=O)C4=C(C=CC(=C4)Cl)Cl

InChI

InChI=1S/C22H15Cl2N5O/c1-12-4-3-5-16-13(2)8-19(27-20(12)16)29-21(14(10-25)11-26-29)28-22(30)17-9-15(23)6-7-18(17)24/h3-9,11H,1-2H3,(H,28,30)