N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(4-oxidanylidenecinnolin-1-yl)propanamide

Systemtic Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(4-oxidanylidenecinnolin-1-yl)propanamide Openeye Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(4-oxocinnolin-1-yl)propanamide CAS Name: N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-(4-oxo-1-cinnolinyl)propanamide IUPAC Name: N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-(4-oxocinnolin-1-yl)propanamide Traditional Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-(4-ketocinnolin-1-yl)propionamide Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CCN3C4=CC=CC=C4C(=O)C=N3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CCN3C4=CC=CC=C4C(=O)C=N3

InChI

InChI=1S/C22H21N5O2/c1-15-22(16(2)27(25-15)17-8-4-3-5-9-17)24-21(29)12-13-26-19-11-7-6-10-18(19)20(28)14-23-26/h3-11,14H,12-13H2,1-2H3,(H,24,29)