2-(6-phenylpyridazin-3-yl)sulfanyl-1-(2,2,4,7-tetramethylquinolin-1-yl)ethanone

Systemtic Name: 2-(6-phenylpyridazin-3-yl)sulfanyl-1-(2,2,4,7-tetramethylquinolin-1-yl)ethanone Openeye Name: 2-(6-phenylpyridazin-3-yl)sulfanyl-1-(2,2,4,7-tetramethyl-1-quinolyl)ethanone CAS Name: 2-[(6-phenyl-3-pyridazinyl)thio]-1-(2,2,4,7-tetramethyl-1-quinolinyl)ethanone IUPAC Name: 2-(6-phenylpyridazin-3-yl)sulfanyl-1-(2,2,4,7-tetramethylquinolin-1-yl)ethanone Traditional Name: 2-[(6-phenylpyridazin-3-yl)thio]-1-(2,2,4,7-tetramethyl-1-quinolyl)ethanone Formula: C25H25N3OS MolecularWeight: 415.5505

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(N2C(=O)CSC3=NN=C(C=C3)C4=CC=CC=C4)(C)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(N2C(=O)CSC3=NN=C(C=C3)C4=CC=CC=C4)(C)C)C

InChI

InChI=1S/C25H25N3OS/c1-17-10-11-20-18(2)15-25(3,4)28(22(20)14-17)24(29)16-30-23-13-12-21(26-27-23)19-8-6-5-7-9-19/h5-15H,16H2,1-4H3