1-methyl-3,5-bis(methylsulfanyl)quinolin-4-one

Systemtic Name: 1-methyl-3,5-bis(methylsulfanyl)quinolin-4-one Openeye Name: 1-methyl-3,5-bis(methylsulfanyl)quinolin-4-one CAS Name: 1-methyl-3,5-bis(methylthio)-4-quinolinone IUPAC Name: 1-methyl-3,5-bis(methylsulfanyl)quinolin-4-one Traditional Name: 1-methyl-3,5-bis(methylthio)-4-quinolone Formula: C12H13NOS2 MolecularWeight: 251.36772

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1C=CC=C2SC)SC

Isomeric SMILES

CN1C=C(C(=O)C2=C1C=CC=C2SC)SC

InChI

InChI=1S/C12H13NOS2/c1-13-7-10(16-3)12(14)11-8(13)5-4-6-9(11)15-2/h4-7H,1-3H3