methyl 6,6-dimethyl-4-oxidanylidene-3-propylsulfanyl-5,7-dihydro-2-benzothiophene-1-carboxylate

Systemtic Name: methyl 6,6-dimethyl-4-oxidanylidene-3-propylsulfanyl-5,7-dihydro-2-benzothiophene-1-carboxylate Openeye Name: methyl 6,6-dimethyl-4-oxo-3-propylsulfanyl-5,7-dihydro-2-benzothiophene-1-carboxylate CAS Name: 6,6-dimethyl-4-oxo-3-(propylthio)-5,7-dihydro-2-benzothiophene-1-carboxylic acid methyl ester IUPAC Name: methyl 6,6-dimethyl-4-oxo-3-propylsulfanyl-5,7-dihydro-2-benzothiophene-1-carboxylate Traditional Name: 4-keto-6,6-dimethyl-3-(propylthio)-5,7-dihydroisobenzothiophene-1-carboxylic acid methyl ester Formula: C15H20O3S2 MolecularWeight: 312.4475

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C2C(=C(S1)C(=O)OC)CC(CC2=O)(C)C

Isomeric SMILES

CCCSC1=C2C(=C(S1)C(=O)OC)CC(CC2=O)(C)C

InChI

InChI=1S/C15H20O3S2/c1-5-6-19-14-11-9(12(20-14)13(17)18-4)7-15(2,3)8-10(11)16/h5-8H2,1-4H3