ethyl 1,1-bis(oxidanylidene)-3-phenylsulfanyl-2,3-dihydro-1-benzothiophene-7-carboxylate

Systemtic Name: ethyl 1,1-bis(oxidanylidene)-3-phenylsulfanyl-2,3-dihydro-1-benzothiophene-7-carboxylate Openeye Name: ethyl 1,1-dioxo-3-phenylsulfanyl-2,3-dihydrobenzothiophene-7-carboxylate CAS Name: 1,1-dioxo-3-(phenylthio)-2,3-dihydro-1-benzothiophene-7-carboxylic acid ethyl ester IUPAC Name: ethyl 1,1-dioxo-3-phenylsulfanyl-2,3-dihydro-1-benzothiophene-7-carboxylate Traditional Name: 1,1-diketo-3-(phenylthio)-2,3-dihydrobenzothiophene-7-carboxylic acid ethyl ester Formula: C17H16O4S2 MolecularWeight: 348.43654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=CC=C1)C(CS2(=O)=O)SC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C2C(=CC=C1)C(CS2(=O)=O)SC3=CC=CC=C3

InChI

InChI=1S/C17H16O4S2/c1-2-21-17(18)14-10-6-9-13-15(11-23(19,20)16(13)14)22-12-7-4-3-5-8-12/h3-10,15H,2,11H2,1H3