(3E,5E)-3,5-bis[(2-methylphenyl)methylidene]thian-4-one

Systemtic Name: (3E,5E)-3,5-bis[(2-methylphenyl)methylidene]thian-4-one Openeye Name: (3E,5E)-3,5-bis(o-tolylmethylene)tetrahydrothiopyran-4-one CAS Name: (3E,5E)-3,5-bis[(2-methylphenyl)methylidene]-4-thianone IUPAC Name: (3E,5E)-3,5-bis[(2-methylphenyl)methylidene]thian-4-one Traditional Name: (3E,5E)-3,5-bis(2-methylbenzylidene)tetrahydrothiopyran-4-one Formula: C21H20OS MolecularWeight: 320.4479

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=C2CSCC(=CC3=CC=CC=C3C)C2=O

Isomeric SMILES

CC1=CC=CC=C1/C=C/2\C(=O)/C(=C\C3=CC=CC=C3C)/CSC2

InChI

InChI=1S/C21H20OS/c1-15-7-3-5-9-17(15)11-19-13-23-14-20(21(19)22)12-18-10-6-4-8-16(18)2/h3-12H,13-14H2,1-2H3/b19-11-,20-12-