3-methylsulfinyl-11-oxidanylidene-benzo[b][1]benzothiepine-9-carbaldehyde

Systemtic Name: 3-methylsulfinyl-11-oxidanylidene-benzo[b][1]benzothiepine-9-carbaldehyde Openeye Name: 3-methylsulfinyl-11-oxo-benzo[b][1]benzothiepine-9-carbaldehyde CAS Name: 3-methylsulfinyl-11-oxo-9-benzo[b][1]benzothiepincarboxaldehyde IUPAC Name: 3-methylsulfinyl-11-oxobenzo[b][1]benzothiepine-9-carbaldehyde Traditional Name: 11-keto-3-methylsulfinyl-benzo[b][1]benzothiepin-9-carbaldehyde Formula: C16H12O3S2 MolecularWeight: 316.39468

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC2=C(C=C1)S(=O)C3=C(C=CC(=C3)C=O)C=C2

Isomeric SMILES

CS(=O)C1=CC2=C(C=C1)S(=O)C3=C(C=CC(=C3)C=O)C=C2

InChI

InChI=1S/C16H12O3S2/c1-20(18)14-6-7-15-13(9-14)5-4-12-3-2-11(10-17)8-16(12)21(15)19/h2-10H,1H3