2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(8-methoxy-2,2,4-trimethyl-quinolin-1-yl)ethanone

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(8-methoxy-2,2,4-trimethyl-quinolin-1-yl)ethanone Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(8-methoxy-2,2,4-trimethyl-1-quinolyl)ethanone CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-(8-methoxy-2,2,4-trimethyl-1-quinolinyl)ethanone IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(8-methoxy-2,2,4-trimethylquinolin-1-yl)ethanone Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-1-(8-methoxy-2,2,4-trimethyl-1-quinolyl)ethanone Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2C3=C(C=CC=C3OC)C(=CC2(C)C)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2C3=C(C=CC=C3OC)C(=CC2(C)C)C)C

InChI

InChI=1S/C21H25N3O2S/c1-13-11-21(4,5)24(19-16(13)8-7-9-17(19)26-6)18(25)12-27-20-22-14(2)10-15(3)23-20/h7-11H,12H2,1-6H3