4-[2,4-bis(chloranyl)phenoxy]-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)butanamide

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)butanamide Openeye Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-4-(2,4-dichlorophenoxy)butanamide CAS Name: N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]-4-(2,4-dichlorophenoxy)butanamide IUPAC Name: N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)-4-(2,4-dichlorophenoxy)butanamide Traditional Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-4-(2,4-dichlorophenoxy)butyramide Formula: C23H17Cl2N5O2 MolecularWeight: 466.31938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)N3C(=C(C=N3)C#N)NC(=O)CCCOC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)N3C(=C(C=N3)C#N)NC(=O)CCCOC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C23H17Cl2N5O2/c24-17-8-9-20(18(25)12-17)32-11-3-6-22(31)29-23-16(13-26)14-27-30(23)21-10-7-15-4-1-2-5-19(15)28-21/h1-2,4-5,7-10,12,14H,3,6,11H2,(H,29,31)