(6E)-4-tert-butyl-6-[(4-methylphenyl)-sulfanyl-methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-4-tert-butyl-6-[(4-methylphenyl)-sulfanyl-methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-4-tert-butyl-6-[p-tolyl(sulfanyl)methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-4-tert-butyl-6-[mercapto-(4-methylphenyl)methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-4-tert-butyl-6-[(4-methylphenyl)-sulfanylmethylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-4-tert-butyl-6-[mercapto(p-tolyl)methylene]cyclohexa-2,4-dien-1-one Formula: C18H20OS MolecularWeight: 284.4158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=C2C=C(C=CC2=O)C(C)(C)C)S

Isomeric SMILES

CC1=CC=C(C=C1)/C(=C\2/C=C(C=CC2=O)C(C)(C)C)/S

InChI

InChI=1S/C18H20OS/c1-12-5-7-13(8-6-12)17(20)15-11-14(18(2,3)4)9-10-16(15)19/h5-11,20H,1-4H3/b17-15+