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

Systemtic Name: 6,6-dimethyl-3-methylsulfanyl-1-pyridin-4-yl-5,7-dihydro-2-benzothiophen-4-one Openeye Name: 6,6-dimethyl-3-methylsulfanyl-1-(4-pyridyl)-5,7-dihydro-2-benzothiophen-4-one CAS Name: 6,6-dimethyl-3-(methylthio)-1-pyridin-4-yl-5,7-dihydro-2-benzothiophen-4-one IUPAC Name: 6,6-dimethyl-3-methylsulfanyl-1-pyridin-4-yl-5,7-dihydro-2-benzothiophen-4-one Traditional Name: 6,6-dimethyl-3-(methylthio)-1-(4-pyridyl)-5,7-dihydroisobenzothiophen-4-one Formula: C16H17NOS2 MolecularWeight: 303.44228

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(SC(=C2C(=O)C1)SC)C3=CC=NC=C3)C

Isomeric SMILES

CC1(CC2=C(SC(=C2C(=O)C1)SC)C3=CC=NC=C3)C

InChI

InChI=1S/C16H17NOS2/c1-16(2)8-11-13(12(18)9-16)15(19-3)20-14(11)10-4-6-17-7-5-10/h4-7H,8-9H2,1-3H3