6,6-dimethyl-3-methylsulfanyl-1-(1,2-oxazol-5-yl)-5,7-dihydro-2-benzothiophen-4-one

Systemtic Name: 6,6-dimethyl-3-methylsulfanyl-1-(1,2-oxazol-5-yl)-5,7-dihydro-2-benzothiophen-4-one Openeye Name: 1-isoxazol-5-yl-6,6-dimethyl-3-methylsulfanyl-5,7-dihydro-2-benzothiophen-4-one CAS Name: 1-(5-isoxazolyl)-6,6-dimethyl-3-(methylthio)-5,7-dihydro-2-benzothiophen-4-one IUPAC Name: 6,6-dimethyl-3-methylsulfanyl-1-(1,2-oxazol-5-yl)-5,7-dihydro-2-benzothiophen-4-one Traditional Name: 1-isoxazol-5-yl-6,6-dimethyl-3-(methylthio)-5,7-dihydroisobenzothiophen-4-one Formula: C14H15NO2S2 MolecularWeight: 293.4044

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(SC(=C2C(=O)C1)SC)C3=CC=NO3)C

Isomeric SMILES

CC1(CC2=C(SC(=C2C(=O)C1)SC)C3=CC=NO3)C

InChI

InChI=1S/C14H15NO2S2/c1-14(2)6-8-11(9(16)7-14)13(18-3)19-12(8)10-4-5-15-17-10/h4-5H,6-7H2,1-3H3