1-[(4S)-6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl]-2-(6-phenylpyridazin-3-yl)sulfanyl-ethanone

Systemtic Name: 1-[(4S)-6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl]-2-(6-phenylpyridazin-3-yl)sulfanyl-ethanone Openeye Name: 1-[(4S)-6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl]-2-(6-phenylpyridazin-3-yl)sulfanyl-ethanone CAS Name: 1-[(4S)-6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl]-2-[(6-phenyl-3-pyridazinyl)thio]ethanone IUPAC Name: 1-[(4S)-6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl]-2-(6-phenylpyridazin-3-yl)sulfanylethanone Traditional Name: 1-[(4S)-6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl]-2-[(6-phenylpyridazin-3-yl)thio]ethanone Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N(C2=C1C=C(C=C2)OC)C(=O)CSC3=NN=C(C=C3)C4=CC=CC=C4)(C)C

Isomeric SMILES

C[C@H]1CC(N(C2=C1C=C(C=C2)OC)C(=O)CSC3=NN=C(C=C3)C4=CC=CC=C4)(C)C

InChI

InChI=1S/C25H27N3O2S/c1-17-15-25(2,3)28(22-12-10-19(30-4)14-20(17)22)24(29)16-31-23-13-11-21(26-27-23)18-8-6-5-7-9-18/h5-14,17H,15-16H2,1-4H3/t17-/m0/s1