1-(7-methoxy-2,2,4-trimethyl-quinolin-1-yl)-2-pyrimidin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(7-methoxy-2,2,4-trimethyl-quinolin-1-yl)-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-(7-methoxy-2,2,4-trimethyl-1-quinolyl)-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-(7-methoxy-2,2,4-trimethyl-1-quinolinyl)-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-(7-methoxy-2,2,4-trimethylquinolin-1-yl)-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-(7-methoxy-2,2,4-trimethyl-1-quinolyl)-2-(2-pyrimidylthio)ethanone Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(C2=C1C=CC(=C2)OC)C(=O)CSC3=NC=CC=N3)(C)C

Isomeric SMILES

CC1=CC(N(C2=C1C=CC(=C2)OC)C(=O)CSC3=NC=CC=N3)(C)C

InChI

InChI=1S/C19H21N3O2S/c1-13-11-19(2,3)22(16-10-14(24-4)6-7-15(13)16)17(23)12-25-18-20-8-5-9-21-18/h5-11H,12H2,1-4H3