2-[2-[(3E)-4-methylhexa-3,5-dienyl]-1,3-dithian-2-yl]cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-[2-[(3E)-4-methylhexa-3,5-dienyl]-1,3-dithian-2-yl]cyclohepta-2,4,6-trien-1-one Openeye Name: 2-[2-[(3E)-4-methylhexa-3,5-dienyl]-1,3-dithian-2-yl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-[2-[(3E)-4-methylhexa-3,5-dienyl]-1,3-dithian-2-yl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-[2-[(3E)-4-methylhexa-3,5-dienyl]-1,3-dithian-2-yl]cyclohepta-2,4,6-trien-1-one Traditional Name: 2-[2-[(3E)-4-methylhexa-3,5-dienyl]-1,3-dithian-2-yl]cyclohepta-2,4,6-trien-1-one Formula: C18H22OS2 MolecularWeight: 318.49668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC1(SCCCS1)C2=CC=CC=CC2=O)C=C

Isomeric SMILES

C/C(=C\CCC1(SCCCS1)C2=CC=CC=CC2=O)/C=C

InChI

InChI=1S/C18H22OS2/c1-3-15(2)9-7-12-18(20-13-8-14-21-18)16-10-5-4-6-11-17(16)19/h3-6,9-11H,1,7-8,12-14H2,2H3/b15-9+