ethyl 5-bromanyl-4-oxidanylidene-3-propylsulfanyl-6,7-dihydro-5H-2-benzothiophene-1-carboxylate

Systemtic Name: ethyl 5-bromanyl-4-oxidanylidene-3-propylsulfanyl-6,7-dihydro-5H-2-benzothiophene-1-carboxylate Openeye Name: ethyl 5-bromo-4-oxo-3-propylsulfanyl-6,7-dihydro-5H-2-benzothiophene-1-carboxylate CAS Name: 5-bromo-4-oxo-3-(propylthio)-6,7-dihydro-5H-2-benzothiophene-1-carboxylic acid ethyl ester IUPAC Name: ethyl 5-bromo-4-oxo-3-propylsulfanyl-6,7-dihydro-5H-2-benzothiophene-1-carboxylate Traditional Name: 5-bromo-4-keto-3-(propylthio)-6,7-dihydro-5H-isobenzothiophene-1-carboxylic acid ethyl ester Formula: C14H17BrO3S2 MolecularWeight: 377.31698

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C2C(=C(S1)C(=O)OCC)CCC(C2=O)Br

Isomeric SMILES

CCCSC1=C2C(=C(S1)C(=O)OCC)CCC(C2=O)Br

InChI

InChI=1S/C14H17BrO3S2/c1-3-7-19-14-10-8(5-6-9(15)11(10)16)12(20-14)13(17)18-4-2/h9H,3-7H2,1-2H3