2-(4-chlorophenyl)carbonyl-N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]benzamide

Systemtic Name: 2-(4-chlorophenyl)carbonyl-N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]benzamide Openeye Name: 2-(4-chlorobenzoyl)-N-[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]benzamide CAS Name: 2-[(4-chlorophenyl)-oxomethyl]-N-[4-cyano-2-(4-methyl-2-quinolinyl)-3-pyrazolyl]benzamide IUPAC Name: 2-(4-chlorobenzoyl)-N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]benzamide Traditional Name: 2-(4-chlorobenzoyl)-N-[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]benzamide Formula: C28H18ClN5O2 MolecularWeight: 491.92782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)N3C(=C(C=N3)C#N)NC(=O)C4=CC=CC=C4C(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)N3C(=C(C=N3)C#N)NC(=O)C4=CC=CC=C4C(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H18ClN5O2/c1-17-14-25(32-24-9-5-4-6-21(17)24)34-27(19(15-30)16-31-34)33-28(36)23-8-3-2-7-22(23)26(35)18-10-12-20(29)13-11-18/h2-14,16H,1H3,(H,33,36)