ethyl 6,8-bis(fluoranyl)-2,7-bis(methylsulfanyl)-4-oxidanylidene-thiochromene-3-carboxylate

Systemtic Name: ethyl 6,8-bis(fluoranyl)-2,7-bis(methylsulfanyl)-4-oxidanylidene-thiochromene-3-carboxylate Openeye Name: ethyl 6,8-difluoro-2,7-bis(methylsulfanyl)-4-oxo-thiochromene-3-carboxylate CAS Name: 6,8-difluoro-2,7-bis(methylthio)-4-oxo-1-benzothiopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6,8-difluoro-2,7-bis(methylsulfanyl)-4-oxothiochromene-3-carboxylate Traditional Name: 6,8-difluoro-4-keto-2,7-bis(methylthio)thiochromene-3-carboxylic acid ethyl ester Formula: C14H12F2O3S3 MolecularWeight: 362.435086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C(C(=C(C=C2C1=O)F)SC)F)SC

Isomeric SMILES

CCOC(=O)C1=C(SC2=C(C(=C(C=C2C1=O)F)SC)F)SC

InChI

InChI=1S/C14H12F2O3S3/c1-4-19-13(18)8-10(17)6-5-7(15)12(20-2)9(16)11(6)22-14(8)21-3/h5H,4H2,1-3H3