N-[4-cyano-2-(4,8-dimethylquinolin-2-yl)pyrazol-3-yl]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[4-cyano-2-(4,8-dimethylquinolin-2-yl)pyrazol-3-yl]-2-thiophen-2-yl-ethanamide Openeye Name: N-[4-cyano-2-(4,8-dimethyl-2-quinolyl)pyrazol-3-yl]-2-(2-thienyl)acetamide CAS Name: N-[4-cyano-2-(4,8-dimethyl-2-quinolinyl)-3-pyrazolyl]-2-thiophen-2-ylacetamide IUPAC Name: N-[4-cyano-2-(4,8-dimethylquinolin-2-yl)pyrazol-3-yl]-2-thiophen-2-ylacetamide Traditional Name: N-[4-cyano-2-(4,8-dimethyl-2-quinolyl)pyrazol-3-yl]-2-(2-thienyl)acetamide Formula: C21H17N5OS MolecularWeight: 387.45758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)N3C(=C(C=N3)C#N)NC(=O)CC4=CC=CS4

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)N3C(=C(C=N3)C#N)NC(=O)CC4=CC=CS4

InChI

InChI=1S/C21H17N5OS/c1-13-5-3-7-17-14(2)9-18(24-20(13)17)26-21(15(11-22)12-23-26)25-19(27)10-16-6-4-8-28-16/h3-9,12H,10H2,1-2H3,(H,25,27)