3-methylsulfanyl-1-prop-2-ynyl-quinolin-4-one

Systemtic Name: 3-methylsulfanyl-1-prop-2-ynyl-quinolin-4-one Openeye Name: 3-methylsulfanyl-1-prop-2-ynyl-quinolin-4-one CAS Name: 3-(methylthio)-1-prop-2-ynyl-4-quinolinone IUPAC Name: 3-methylsulfanyl-1-prop-2-ynylquinolin-4-one Traditional Name: 3-(methylthio)-1-propargyl-4-quinolone Formula: C13H11NOS MolecularWeight: 229.29754

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CN(C2=CC=CC=C2C1=O)CC#C

Isomeric SMILES

CSC1=CN(C2=CC=CC=C2C1=O)CC#C

InChI

InChI=1S/C13H11NOS/c1-3-8-14-9-12(16-2)13(15)10-6-4-5-7-11(10)14/h1,4-7,9H,8H2,2H3