(4Z)-2-methyl-6-(octylsulfanylmethyl)-4-(octylsulfanylmethylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: (4Z)-2-methyl-6-(octylsulfanylmethyl)-4-(octylsulfanylmethylidene)cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-2-methyl-6-(octylsulfanylmethyl)-4-(octylsulfanylmethylene)cyclohexa-2,5-dien-1-one CAS Name: (4Z)-2-methyl-6-[(octylthio)methyl]-4-[(octylthio)methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-2-methyl-6-(octylsulfanylmethyl)-4-(octylsulfanylmethylidene)cyclohexa-2,5-dien-1-one Traditional Name: (4Z)-2-methyl-6-[(octylthio)methyl]-4-[(octylthio)methylene]cyclohexa-2,5-dien-1-one Formula: C25H42OS2 MolecularWeight: 422.73038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSCC1=CC(=CSCCCCCCCC)C=C(C1=O)C

Isomeric SMILES

CCCCCCCCSCC1=C/C(=C\SCCCCCCCC)/C=C(C1=O)C

InChI

InChI=1S/C25H42OS2/c1-4-6-8-10-12-14-16-27-20-23-18-22(3)25(26)24(19-23)21-28-17-15-13-11-9-7-5-2/h18-20H,4-17,21H2,1-3H3/b23-20-