3-methylsulfanyl-1-pyridin-3-yl-6,7-dihydro-5H-2-benzothiophen-4-one

Systemtic Name: 3-methylsulfanyl-1-pyridin-3-yl-6,7-dihydro-5H-2-benzothiophen-4-one Openeye Name: 3-methylsulfanyl-1-(3-pyridyl)-6,7-dihydro-5H-2-benzothiophen-4-one CAS Name: 3-(methylthio)-1-(3-pyridinyl)-6,7-dihydro-5H-2-benzothiophen-4-one IUPAC Name: 3-methylsulfanyl-1-pyridin-3-yl-6,7-dihydro-5H-2-benzothiophen-4-one Traditional Name: 3-(methylthio)-1-(3-pyridyl)-6,7-dihydro-5H-isobenzothiophen-4-one Formula: C14H13NOS2 MolecularWeight: 275.38912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C2C(=C(S1)C3=CN=CC=C3)CCCC2=O

Isomeric SMILES

CSC1=C2C(=C(S1)C3=CN=CC=C3)CCCC2=O

InChI

InChI=1S/C14H13NOS2/c1-17-14-12-10(5-2-6-11(12)16)13(18-14)9-4-3-7-15-8-9/h3-4,7-8H,2,5-6H2,1H3