3,5-bis(methylsulfanyl)-1-phenyl-4H-pentalen-1-ol

Systemtic Name: 3,5-bis(methylsulfanyl)-1-phenyl-4H-pentalen-1-ol Openeye Name: 3,5-bis(methylsulfanyl)-1-phenyl-4H-pentalen-1-ol CAS Name: 3,5-bis(methylthio)-1-phenyl-4H-pentalen-1-ol IUPAC Name: 3,5-bis(methylsulfanyl)-1-phenyl-4H-pentalen-1-ol Traditional Name: 3,5-bis(methylthio)-1-phenyl-4H-pentalen-1-ol Formula: C16H16OS2 MolecularWeight: 288.42764

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C1)C(=CC2(C3=CC=CC=C3)O)SC

Isomeric SMILES

CSC1=CC2=C(C1)C(=CC2(C3=CC=CC=C3)O)SC

InChI

InChI=1S/C16H16OS2/c1-18-12-8-13-14(9-12)16(17,10-15(13)19-2)11-6-4-3-5-7-11/h3-7,9-10,17H,8H2,1-2H3