3,4-bis(chloranyl)-N-[4-cyano-2-(8-methoxy-4-methyl-quinolin-2-yl)pyrazol-3-yl]benzamide

Systemtic Name: 3,4-bis(chloranyl)-N-[4-cyano-2-(8-methoxy-4-methyl-quinolin-2-yl)pyrazol-3-yl]benzamide Openeye Name: 3,4-dichloro-N-[4-cyano-2-(8-methoxy-4-methyl-2-quinolyl)pyrazol-3-yl]benzamide CAS Name: 3,4-dichloro-N-[4-cyano-2-(8-methoxy-4-methyl-2-quinolinyl)-3-pyrazolyl]benzamide IUPAC Name: 3,4-dichloro-N-[4-cyano-2-(8-methoxy-4-methylquinolin-2-yl)pyrazol-3-yl]benzamide Traditional Name: 3,4-dichloro-N-[4-cyano-2-(8-methoxy-4-methyl-2-quinolyl)pyrazol-3-yl]benzamide Formula: C22H15Cl2N5O2 MolecularWeight: 452.2928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OC)N3C(=C(C=N3)C#N)NC(=O)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OC)N3C(=C(C=N3)C#N)NC(=O)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H15Cl2N5O2/c1-12-8-19(27-20-15(12)4-3-5-18(20)31-2)29-21(14(10-25)11-26-29)28-22(30)13-6-7-16(23)17(24)9-13/h3-9,11H,1-2H3,(H,28,30)