2,2-bis(methylsulfanyl)-1-pyridin-3-yl-ethanone

Systemtic Name: 2,2-bis(methylsulfanyl)-1-pyridin-3-yl-ethanone Openeye Name: 2,2-bis(methylsulfanyl)-1-(3-pyridyl)ethanone CAS Name: 2,2-bis(methylthio)-1-(3-pyridinyl)ethanone IUPAC Name: 2,2-bis(methylsulfanyl)-1-pyridin-3-ylethanone Traditional Name: 2,2-bis(methylthio)-1-(3-pyridyl)ethanone Formula: C9H11NOS2 MolecularWeight: 213.31974

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Descriptors Computed from Structure

Canonical SMILES:

CSC(C(=O)C1=CN=CC=C1)SC

Isomeric SMILES

CSC(C(=O)C1=CN=CC=C1)SC

InChI

InChI=1S/C9H11NOS2/c1-12-9(13-2)8(11)7-4-3-5-10-6-7/h3-6,9H,1-2H3