1-(8-methoxy-4-phenylsulfanyl-quinolin-3-yl)butan-1-one

Systemtic Name: 1-(8-methoxy-4-phenylsulfanyl-quinolin-3-yl)butan-1-one Openeye Name: 1-(8-methoxy-4-phenylsulfanyl-3-quinolyl)butan-1-one CAS Name: 1-[8-methoxy-4-(phenylthio)-3-quinolinyl]-1-butanone IUPAC Name: 1-(8-methoxy-4-phenylsulfanylquinolin-3-yl)butan-1-one Traditional Name: 1-[8-methoxy-4-(phenylthio)-3-quinolyl]butan-1-one Formula: C20H19NO2S MolecularWeight: 337.43536

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN=C2C(=C1SC3=CC=CC=C3)C=CC=C2OC

Isomeric SMILES

CCCC(=O)C1=CN=C2C(=C1SC3=CC=CC=C3)C=CC=C2OC

InChI

InChI=1S/C20H19NO2S/c1-3-8-17(22)16-13-21-19-15(11-7-12-18(19)23-2)20(16)24-14-9-5-4-6-10-14/h4-7,9-13H,3,8H2,1-2H3