3-quinolin-2-ylsulfanylbutan-2-one

Systemtic Name: 3-quinolin-2-ylsulfanylbutan-2-one Openeye Name: 3-(2-quinolylsulfanyl)butan-2-one CAS Name: 3-(2-quinolinylthio)-2-butanone IUPAC Name: 3-quinolin-2-ylsulfanylbutan-2-one Traditional Name: 3-(2-quinolylthio)butan-2-one Formula: C13H13NOS MolecularWeight: 231.31342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)SC1=NC2=CC=CC=C2C=C1

Isomeric SMILES

CC(C(=O)C)SC1=NC2=CC=CC=C2C=C1

InChI

InChI=1S/C13H13NOS/c1-9(15)10(2)16-13-8-7-11-5-3-4-6-12(11)14-13/h3-8,10H,1-2H3