1-(3-methyl-4-oxidanyl-5-quinolin-8-ylsulfanyl-phenyl)propan-1-one

Systemtic Name: 1-(3-methyl-4-oxidanyl-5-quinolin-8-ylsulfanyl-phenyl)propan-1-one Openeye Name: 1-[4-hydroxy-3-methyl-5-(8-quinolylsulfanyl)phenyl]propan-1-one CAS Name: 1-[4-hydroxy-3-methyl-5-(8-quinolinylthio)phenyl]-1-propanone IUPAC Name: 1-(4-hydroxy-3-methyl-5-quinolin-8-ylsulfanylphenyl)propan-1-one Traditional Name: 1-[4-hydroxy-3-methyl-5-(8-quinolylthio)phenyl]propan-1-one Formula: C19H17NO2S MolecularWeight: 323.40878

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=C(C(=C1)SC2=CC=CC3=C2N=CC=C3)O)C

Isomeric SMILES

CCC(=O)C1=CC(=C(C(=C1)SC2=CC=CC3=C2N=CC=C3)O)C

InChI

InChI=1S/C19H17NO2S/c1-3-15(21)14-10-12(2)19(22)17(11-14)23-16-8-4-6-13-7-5-9-20-18(13)16/h4-11,22H,3H2,1-2H3