2-[[3,4-dimethyl-6-(phenylcarbonyl)-2,5-dihydrothiopyran-6-yl]disulfanyl]-1-phenyl-ethanone

Systemtic Name: 2-[[3,4-dimethyl-6-(phenylcarbonyl)-2,5-dihydrothiopyran-6-yl]disulfanyl]-1-phenyl-ethanone Openeye Name: 2-[(6-benzoyl-3,4-dimethyl-2,5-dihydrothiopyran-6-yl)disulfanyl]-1-phenyl-ethanone CAS Name: 2-[(6-benzoyl-3,4-dimethyl-2,5-dihydrothiopyran-6-yl)disulfanyl]-1-phenylethanone IUPAC Name: 2-[(6-benzoyl-3,4-dimethyl-2,5-dihydrothiopyran-6-yl)disulfanyl]-1-phenylethanone Traditional Name: 2-[(6-benzoyl-3,4-dimethyl-2,5-dihydrothiopyran-6-yl)disulfanyl]-1-phenyl-ethanone Formula: C22H22O2S3 MolecularWeight: 414.60388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CSC(C1)(C(=O)C2=CC=CC=C2)SSCC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(CSC(C1)(C(=O)C2=CC=CC=C2)SSCC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C22H22O2S3/c1-16-13-22(25-14-17(16)2,21(24)19-11-7-4-8-12-19)27-26-15-20(23)18-9-5-3-6-10-18/h3-12H,13-15H2,1-2H3