7-[4-(cyclopentylmethyl)phenyl]-6-(4-methylsulfonylphenyl)-9-thiaspiro[4.4]non-6-en-8-one

Systemtic Name: 7-[4-(cyclopentylmethyl)phenyl]-6-(4-methylsulfonylphenyl)-9-thiaspiro[4.4]non-6-en-8-one Openeye Name: 7-[4-(cyclopentylmethyl)phenyl]-6-(4-methylsulfonylphenyl)-9-thiaspiro[4.4]non-6-en-8-one CAS Name: 7-[4-(cyclopentylmethyl)phenyl]-6-(4-methylsulfonylphenyl)-9-thiaspiro[4.4]non-6-en-8-one IUPAC Name: 7-[4-(cyclopentylmethyl)phenyl]-6-(4-methylsulfonylphenyl)-9-thiaspiro[4.4]non-6-en-8-one Traditional Name: 7-[4-(cyclopentylmethyl)phenyl]-6-(4-mesylphenyl)-9-thiaspiro[4.4]non-6-en-8-one Formula: C27H30O3S2 MolecularWeight: 466.6553

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)SC23CCCC3)C4=CC=C(C=C4)CC5CCCC5

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)SC23CCCC3)C4=CC=C(C=C4)CC5CCCC5

InChI

InChI=1S/C27H30O3S2/c1-32(29,30)23-14-12-22(13-15-23)25-24(26(28)31-27(25)16-4-5-17-27)21-10-8-20(9-11-21)18-19-6-2-3-7-19/h8-15,19H,2-7,16-18H2,1H3