4-[8-(4-methylsulfonylphenyl)spiro[4.4]nona-6,8-dien-7-yl]benzenethiol

Systemtic Name: 4-[8-(4-methylsulfonylphenyl)spiro[4.4]nona-6,8-dien-7-yl]benzenethiol Openeye Name: 4-[8-(4-methylsulfonylphenyl)spiro[4.4]nona-6,8-dien-7-yl]benzenethiol CAS Name: 4-[8-(4-methylsulfonylphenyl)-7-spiro[4.4]nona-6,8-dienyl]benzenethiol IUPAC Name: 4-[8-(4-methylsulfonylphenyl)spiro[4.4]nona-6,8-dien-7-yl]benzenethiol Traditional Name: 4-[8-(4-mesylphenyl)spiro[4.4]nona-6,8-dien-7-yl]benzenethiol Formula: C22H22O2S2 MolecularWeight: 382.53888

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC3(CCCC3)C=C2C4=CC=C(C=C4)S

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC3(CCCC3)C=C2C4=CC=C(C=C4)S

InChI

InChI=1S/C22H22O2S2/c1-26(23,24)19-10-6-17(7-11-19)21-15-22(12-2-3-13-22)14-20(21)16-4-8-18(25)9-5-16/h4-11,14-15,25H,2-3,12-13H2,1H3