1-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanyl-3,3-dimethyl-butan-2-one

Systemtic Name: 1-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanyl-3,3-dimethyl-butan-2-one Openeye Name: 1-[(7-methoxy-4-phenyl-2-quinolyl)sulfanyl]-3,3-dimethyl-butan-2-one CAS Name: 1-[(7-methoxy-4-phenyl-2-quinolinyl)thio]-3,3-dimethyl-2-butanone IUPAC Name: 1-(7-methoxy-4-phenylquinolin-2-yl)sulfanyl-3,3-dimethylbutan-2-one Traditional Name: 1-[(7-methoxy-4-phenyl-2-quinolyl)thio]-3,3-dimethyl-butan-2-one Formula: C22H23NO2S MolecularWeight: 365.48852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NC2=C(C=CC(=C2)OC)C(=C1)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NC2=C(C=CC(=C2)OC)C(=C1)C3=CC=CC=C3

InChI

InChI=1S/C22H23NO2S/c1-22(2,3)20(24)14-26-21-13-18(15-8-6-5-7-9-15)17-11-10-16(25-4)12-19(17)23-21/h5-13H,14H2,1-4H3