N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-(4,8-dimethyl-2-oxidanylidene-quinolin-1-yl)butanamide

Systemtic Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-(4,8-dimethyl-2-oxidanylidene-quinolin-1-yl)butanamide Openeye Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-(4,8-dimethyl-2-oxo-1-quinolyl)butanamide CAS Name: N-(4-cyano-2-phenyl-3-pyrazolyl)-2-(4,8-dimethyl-2-oxo-1-quinolinyl)butanamide IUPAC Name: N-(4-cyano-2-phenylpyrazol-3-yl)-2-(4,8-dimethyl-2-oxoquinolin-1-yl)butanamide Traditional Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-(2-keto-4,8-dimethyl-1-quinolyl)butyramide Formula: C25H23N5O2 MolecularWeight: 425.48242

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=NN1C2=CC=CC=C2)C#N)N3C(=O)C=C(C4=C3C(=CC=C4)C)C

Isomeric SMILES

CCC(C(=O)NC1=C(C=NN1C2=CC=CC=C2)C#N)N3C(=O)C=C(C4=C3C(=CC=C4)C)C

InChI

InChI=1S/C25H23N5O2/c1-4-21(29-22(31)13-17(3)20-12-8-9-16(2)23(20)29)25(32)28-24-18(14-26)15-27-30(24)19-10-6-5-7-11-19/h5-13,15,21H,4H2,1-3H3,(H,28,32)